2-ethyl octine carbonate
ethyl 2-nonynoate
 
Notes:
Flavouring ingredient
  • BOC Sciences
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      Product(s):
      10031-92-2 Ethyl 2-nonynoate
       
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      05-56500 ETHYL-2-NONYNOATE
       
  • Synerzine
    • Synerzine, Inc.
      Innovation. Customization. Aroma Ingredients.
      Synerzine is a leading supplier of flavor and fragrance ingredients.
      Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust.
      Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster.
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      Product(s):
      W0604 Ethyl 2-nonynoate
       
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      N0596 Ethyl 2-Nonynoate
       
Synonyms   Articles   Notes   Search
CAS Number: 10031-92-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 233-098-0
FDA UNII: 853DED009T
Nikkaji Web: J241.237C
MDL: MFCD00036553
CoE Number: 480
XlogP3-AA: 4.10 (est)
Molecular Weight: 182.26286000
Formula: C11 H18 O2
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist: Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
JECFA Food Flavoring: 1352  ethyl 2-nonynoate
DG SANTE Food Flavourings: 09.157  ethyl 2-nonynoate
FEMA Number: 2448 ethyl 2-nonynoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):10031-92-2 ; ETHYL 2-NONYNOATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 96.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.89800 to 0.90800 @  25.00 °C.
Pounds per Gallon - (est).: 7.472 to  7.555
Refractive Index: 1.44300 to 1.45300 @  20.00 °C.
Boiling Point: 121.00 to  122.00 °C. @ 13.00 mm Hg
Boiling Point: 85.00 °C. @ 2.00 mm Hg
Vapor Pressure: 0.011000 mmHg @ 25.00 °C. (est)
Vapor Density: >1 ( Air = 1 )
Flash Point: > 220.00 °F. TCC ( > 104.44 °C. )
logP (o/w): 4.239 (est)
Soluble in:
 alcohol
 water, 46.45 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: floral
 
Odor Strength: high ,
recommend smelling in a 1.00 % solution or less
 
 violet leaf  green  cucumber  floral  
Odor Description:
at 1.00 % in dipropylene glycol. 
violet leaves green cucumber floral
 
 
Flavor Type: cucumber
 
 cucumber  green  
Taste Description:
cucumber green
 
Odor and/or flavor descriptions from others (if found).
 
Bedoukian Research
ETHYL OCTINE CARBONATE ≥98.0%, kosher
Odor Description: A floral, violet odor
Taste Description: green
Can be used in grape, raspberry, and other berry flavors.
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
Ethyl 2-nonynoate
Parchem
2-ethyl octine carbonate
Penta International
ETHYL-2-NONYNOATE
Synerzine
Ethyl 2-nonynoate
TCI AMERICA
For experimental / research use only.
Ethyl 2-Nonynoate
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Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Human Experience:
2 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50  2850 mg/kg
Can be used in grape, raspberry, and other berry flavors.

Dermal Toxicity:
skin-rabbit LD50 5000 mg/kg
Can be used in grape, raspberry, and other berry flavors.

Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavoring agents
IFRA Critical Effect: Insufficient data
IFRA: View Standard
Recommendation for 2-ethyl octine carbonate usage levels up to:
 PROHIBITED: Should not be used as a fragrance ingredient.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 1.10 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.90 (μg/capita/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: -1.20000
beverages(nonalcoholic): -0.56000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.55000
fruit ices: -0.55000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -0.52000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
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Safety References:
Flavor & Extract Manufacturers Association (FEMA) reference(s):
The FEMA GRAS assessment of alpha,beta-unsaturated aldehydes and related substances used as flavor ingredients. View pdf
European Food Safety Athority(EFSA): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Scientific Opinion on Flavouring Group Evaluation 71: Consideration of aliphatic, linear, alpha,beta-unsaturated carboxylic acids and related esters
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 96 (FGE.96): Consideration of 88 flavouring substances considered by EFSA for which EU production volumes / anticipated production volumes have been submitted on request by DG SANCO. Addendum to FGE. 51, 52, 53, 54, 56, 58, 61, 62, 63, 64, 68, 69, 70, 71, 73, 76, 77, 79, 80, 83, 84, 85 and 87.
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 71 Revision 1 (FGE.71Rev1): consideration of aliphatic, linear, a,-unsaturated alcohols, aldehydes, carboxylic acids, and related esters evaluated by JECFA (63rd and 69th meeting) structurally related to flavouring substances evaluated in FGE.05Rev3
View page or View pdf
EPI System: View
EPA Substance Registry Services (TSCA): 10031-92-2
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 61451
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 ethyl non-2-ynoate
Chemidplus: 0010031922
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References:
 ethyl non-2-ynoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 10031-92-2
Pubchem (cid): 61451
Pubchem (sid): 135017164
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS): View
HMDB (The Human Metabolome Database): HMDB36215
FooDB: FDB015073
Export Tariff Code: 2912.19.5000
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
No odor group found for these
pseudomethyl iononeCS
pseudo-isomethyl iononeCS
(E)-beta-methyl iononeFL/FR
aldehydic
 muguet undecadienalFR
balsamic
 cinnamyl formateFL/FR
citrus
 citral dimethyl acetalFL/FR
(E)-4-decenalFL/FR
 grapefruit pentanolFR
 petitgrain combava oilFR
earthy
 octyl phenyl acetateFL/FR
ethereal
isovaleraldehyde propylene glycol acetalFL/FR
fatty
2-decenalFL/FR
2-nonen-1-olFL/FR
(E)-2-nonenalFL/FR
(Z)-2-octenal 
(E)-2-octenalFL/FR
floral
 allyl anthranilateFL/FR
 amyl benzoateFL/FR
 anisyl propanal / methyl anthranilate schiff's baseFR
alpha-butyl cinnamaldehydeFL/FR
 cassie absoluteFL/FR
 citronellyl acetateFL/FR
 citronellyl propionateFL/FR
 coranol (Firmenich)FR
 cumin carbinolFR
 cuminyl acetaldehydeFL/FR
 dihydrolinaloolFL/FR
 dimethyl alpha-iononeFR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
6,8-dimethyl-2-nonanolFR
3,6-dimethyl-3-octanolFL/FR
 ethyl 2-benzyl butyrateFL/FR
 ethyl linaloolFR
 ethyl linalyl acetalFR
 ethyl linalyl acetateFR
 ethyl linalyl etherFL/FR
 farnesyl acetateFL/FR
 floral butanalFR
 gardenia absoluteFR
 geranium oil bourbonFL/FR
 geranyl acetoneFL/FR
 geranyl isobutyrateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 ho leaf oilFR
 ho wood oilFR
 hydroxycitronellal diethyl acetalFL/FR
beta-ionolFL/FR
alpha-iononeFL/FR
alpha-ionyl acetateFR
 jasmin cyclopentanolFR
 jonquil absoluteFR
laevo-linaloolFL/FR
 linaloolFL/FR
dextro-linaloolFL/FR
 linalool oxideFL/FR
 linalyl anthranilateFL/FR
N-methyl iononeFR
beta-isomethyl iononeFL/FR
alpha-isomethyl ionone (50% min.)FL/FR
alpha-isomethyl ionone (60% min.)FL/FR
alpha-isomethyl ionone (70% min.)FL/FR
alpha-isomethyl ionone (80% min.)FL/FR
alpha-isomethyl ionone (90% min.)FL/FR
 mimosa absolute franceFL/FR
 neroli oil bigardeFL/FR
 nerolidolFL/FR
 ocean propanal / methyl anthranilate schiff's baseFR
 orange leaf absoluteFL/FR
 orris butenoneFR
 orris pyridine 25% IPMFR
 papaya isobutyrateFL/FR
 phenyl acetaldehyde diisobutyl acetalFL/FR
2-phenyl propionaldehyde ethylene glycol acetalFR
 rose butanoateFL/FR
 styralyl formateFL/FR
 sweet pea absoluteFR
 terpinyl isobutyrateFL/FR
 tetrahydroionolFR
 tetrahydrolinaloolFL/FR
 verdyl acetateFR
 violet flower absoluteFL/FR
 violet methyl carbonateFR
fruity
 benzyl methyl etherFL/FR
 dimethyl succinateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
2-hexen-1-olFL/FR
(E)-2-hexen-1-olFL/FR
 peach pivalateFR
green
 acetaldehyde butyl phenethyl acetalFL/FR
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
isoamyl 3-(2-furan) propionateFL/FR
isobutyl benzyl carbinolFL/FR
 chrysanthemum oxideFL/FR
3,5,6-neocyclocitralFR
 decanal propylene glycol acetalFL/FR
 earthy acetalFL/FR
 galbanum oil terpenelessFL/FR
 geranium absoluteFL/FR
1-heptanolFL/FR
 heptyl cinnamateFL/FR
(Z)-2-hexen-1-olFL/FR
3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (Z)-3-hexenoateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
(Z)-3-hexen-1-yl pyruvateFL/FR
3-hexenalFL/FR
 hexoxyacetaldehyde dimethyl acetalFR
 hyacinth absoluteFL/FR
 ivy carbaldehyde / methyl anthranilate schiff's baseFR
 ivy dioxolaneFR
(Z)-leaf acetalFL/FR
 leafy acetalFL/FR
 manzanate (Givaudan)FL/FR
 methyl cyclocitrone (IFF)FR
 methyl heptine carbonateFL/FR
para-methyl hydratropaldehydeFL/FR
 methyl octine carbonateFL/FR
4-methyl-4-phenyl pentanoneFR
(Z,Z)-3,6-nonadien-1-olFL/FR
3,6-nonadien-1-olFL/FR
2,6-nonadien-1-olFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
(E,Z)-2,6-nonadien-1-yl acetateFL/FR
(E,Z)-2,6-nonadienalFL/FR
2,6-nonadienalFL/FR
(E,Z)-2,6-nonadienal diethyl acetalFL/FR
(Z)-2-nonen-1-olFL/FR
(E)-2-nonen-1-olFL/FR
2-nonyn-1-al dimethyl acetalFR
 octanal dimethyl acetalFL/FR
(Z)-5-octen-1-yl propionateFL/FR
 octyl oxyacetaldehydeFR
 phenyl acetaldehydeFL/FR
3-phenyl propionaldehydeFL/FR
isopropyl phenyl propionaldehydeFR
 rose leaf absolute (rosa centifolia)FL/FR
 styralyl acetateFL/FR
 violet decenolFR
 violet dienyneFR
 violet leaf absoluteFL/FR
 violet leaf absolute egyptFL/FR
 violet leaf concreteFR
 violet nitrileFR
herbal
sweet basil absoluteFL/FR
 clary sage absoluteFL/FR
 herbal heptaneFR
marine
 marine hexaneFR
melon
(Z)-6-nonenalFL/FR
minty
isopulegyl formateFL/FR
pine
 plectranthus glandulosus hook f. leaf oil cameroonFR
powdery
alpha-methyl iononeFL/FR
(E)-alpha-methyl ionone (44-50%)FL/FR
(E)-alpha-methyl ionone (50-60%)FL/FR
(E)-alpha-methyl ionone (74-80%)FL/FR
spicy
 cubeb oilFL/FR
waxy
3-decanoneFL/FR
 orris rhizome oil CO2 extractFL/FR
 violet propanolFR
 
For Flavor
 
No flavor group found for these
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 allyl anthranilateFL/FR
 amyl benzoateFL/FR
alpha-campholene acetateFL
 decanal propylene glycol acetalFL/FR
3-decanoneFL/FR
(Z)-6-decenalFL
 earthy acetalFL/FR
 ethyl 2-benzyl butyrateFL/FR
 ethyl linalyl etherFL/FR
 heptyl cinnamateFL/FR
3-hexen-1-olFL/FR
(E)-2-hexenalFL
2-hexenalFL
 hyacinth absoluteFL/FR
dextro-linaloolFL/FR
beta-isomethyl iononeFL/FR
(E)-beta-methyl iononeFL/FR
(E)-alpha-methyl ionone (44-50%)FL/FR
(E)-alpha-methyl ionone (50-60%)FL/FR
alpha-isomethyl ionone (60% min.)FL/FR
3-methyl-3-pentanolFL
2,6-nonadienalFL/FR
2,4,6-nonatrienalFL
(Z)-2-octenal 
 octyl phenyl acetateFL/FR
isopulegyl formateFL/FR
 styralyl formateFL/FR
 terpinyl isobutyrateFL/FR
isoamyl 3-(2-furan) propionateFL/FR
alpha-butyl cinnamaldehydeFL/FR
amber
isobutyl benzyl carbinolFL/FR
apple
(E,Z)-2,6-nonadien-1-olFL/FR
aromatic
 leafy acetalFL/FR
citrus
 citral dimethyl acetalFL/FR
 linaloolFL/FR
laevo-linaloolFL/FR
cooling
 manzanate (Givaudan)FL/FR
fatty
2-decenalFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
2-nonen-1-olFL/FR
(Z)-2-nonen-1-olFL/FR
(E)-2-octenalFL/FR
floral
 citronellyl acetateFL/FR
 citronellyl propionateFL/FR
 dihydrolinaloolFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 farnesyl acetateFL/FR
 geranium oil bourbonFL/FR
 geranyl acetoneFL/FR
 geranyl isobutyrateFL/FR
beta-ionolFL/FR
alpha-iononeFL/FR
 linalyl anthranilateFL/FR
alpha-isomethyl ionone (50% min.)FL/FR
alpha-isomethyl ionone (70% min.)FL/FR
(E)-alpha-methyl ionone (74-80%)FL/FR
alpha-isomethyl ionone (80% min.)FL/FR
alpha-isomethyl ionone (90% min.)FL/FR
 neroli oil bigardeFL/FR
 orange leaf absoluteFL/FR
 tetrahydrolinaloolFL/FR
 violet flower absoluteFL/FR
fruity
 benzyl methyl etherFL/FR
 dimethyl succinateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
2-hexen-1-olFL/FR
alpha-methyl iononeFL/FR
 rose butanoateFL/FR
 styralyl acetateFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
green
 acetaldehyde butyl phenethyl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 chrysanthemum oxideFL/FR
 clary sage absoluteFL/FR
 cucumber distillatesFL
 cuminyl acetaldehydeFL/FR
 galbanum oil terpenelessFL/FR
 geranium absoluteFL/FR
(E)-2-hexen-1-olFL/FR
(Z)-2-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (Z)-3-hexenoateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
(Z)-3-hexen-1-yl pyruvateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
3-hexenalFL/FR
(Z)-leaf acetalFL/FR
 linalool oxideFL/FR
 methyl 2-undecynoateFL
 methyl heptine carbonateFL/FR
para-methyl hydratropaldehydeFL/FR
 methyl octine carbonateFL/FR
 nerolidolFL/FR
3,6-nonadien-1-olFL/FR
2,6-nonadien-1-olFL/FR
(E,Z)-2,6-nonadien-1-yl acetateFL/FR
(E,E)-2,6-nonadienalFL
(E,Z)-2,6-nonadienalFL/FR
(E,Z)-2,6-nonadienal diethyl acetalFL/FR
(E)-2-nonen-1-olFL/FR
(Z)-6-nonenalFL/FR
(E)-2-nonenalFL/FR
 octanal dimethyl acetalFL/FR
(Z)-5-octen-1-yl propionateFL/FR
 papaya isobutyrateFL/FR
 phenyl acetaldehyde diisobutyl acetalFL/FR
3-phenyl propionaldehydeFL/FR
 rose leaf absolute (rosa centifolia)FL/FR
 violet leaf absoluteFL/FR
 violet leaf absolute egyptFL/FR
herbal
sweet basil absoluteFL/FR
3,6-dimethyl-3-octanolFL/FR
honey
 phenyl acetaldehydeFL/FR
medicinal
 dimethyl benzyl carbinolFL/FR
melon
 hydroxycitronellal diethyl acetalFL/FR
ripe
(E)-4-decenalFL/FR
solvent
1-heptanolFL/FR
spicy
 cassie absoluteFL/FR
 cinnamyl formateFL/FR
 cubeb oilFL/FR
waxy
alpha-hexyl cinnamaldehydeFL/FR
 mimosa absolute franceFL/FR
(Z,Z)-3,6-nonadien-1-olFL/FR
woody
 orris rhizome oil CO2 extractFL/FR
 
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Potential Uses:
 cassieFR
 cucumberFL
 frangipani plumeriaFR
 freesiaFR
 fruitFR
 greenFL
 jasminFL
 jonquilFR
 leaf 
 linden flowerFR
 orrisFR
 resedaFR
 tuberoseFR
 violetFL
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
 ethyl 2-nonynoate
 ethyl non-2-ynoate
 ethyl nonynoate
 ethyl octinecarbonate
2-ethyl octyn carbonate
 ethyl octyne carbonate
2-ethyl octyne carbonate
 ethyl-2-nonynoate
2-nonynoic acid ethyl ester
2-nonynoic acid, ethyl ester
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Articles:
 None found yet.
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