2-phenyl propyl butyrate
2-phenylpropyl butyrate
 
Notes:
Flavouring ingredient
  • Beijing Lys Chemicals
    • Beijing Lys Chemicals Co, LTD.
      From Grams to Tons
      Fine chemical high-tech company which contains R&D, production, and sales.
      BEIJING LYS CHEMICALS CO, LTD, established in 2004, is a fine chemical high-tech company which contains R&D, production, and sales. We mainly engaged in export and technology development of flavor and fragrance materials and pharmaceutical intermediates. We have nearly 500 kinds of products, from grams to tons, exported to USA, Europe, South Asia and etc. And we custom manufacture new products according to customers’ needs, and serve good quality products and service. Our goal is to become a fine chemical enterprise which could provide special products and services.
      Email: Mr. Jia
      Email: Mr. Guo
      Voice: 86-10-68418738
      Fax: 86-10-68418739
      Mr. Guo86-10-68483445
      Mr. Guo86-10-68418739
      News
      Product(s):
      10131 2-Phenyl-1-propyl butyrate
       
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
      US Email: Technical Services
      US Email: Sales
      US Voice: (973) 740-2300
      US Fax: (973) 740-1839
      Product(s):
      16-45000 2-PHENYLPROPYL BUTYRATE, Kosher
       
  • 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.
      US Email: Customer Service
      US Email: Sales
      US Voice: (404) 524-6744
      US Fax: (404) 577-1651
      Inquiry
      Products List: View
      Product(s):
      W1713 2-Phenylpropyl Butyrate
       
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2-phenylpropyl butanoate (Click)
CAS Number: 80866-83-7Picture of molecule
ECHA EINECS - REACH Pre-Reg: 279-587-2
FDA UNII: 38G1J8241Q
Nikkaji Web: J149.941F
MDL: MFCD00009393
CoE Number: 285
XlogP3-AA: 3.20 (est)
Molecular Weight: 206.28486000
Formula: C13 H18 O2
NMR Predictor: Predict (works with chrome or firefox)
[(2R)-2-phenylpropyl] butanoate (Click)
CAS Number: 80866-83-7  (R)Picture of molecule
XlogP3-AA: 3.20 (est)
Molecular Weight: 206.28486000
Formula: C13 H18 O2
NMR Predictor: Predict (works with chrome or firefox)
[(2S)-2-phenylpropyl] butanoate (Click)
CAS Number: 80866-83-7  (S)Picture of molecule
XlogP3-AA: 3.20 (est)
Molecular Weight: 206.28486000
Formula: C13 H18 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: flavor and fragrance 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
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 1469  2-phenylpropyl butyrate
Flavis Number: 09.057 (Old)
DG SANTE Food Flavourings: 09.057  2-phenylpropyl butyrate
FEMA Number: 2891  2-phenylpropyl butyrate
FDA Mainterm: 2-PHENYLPROPYL BUTYRATE
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: 98.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.99100 @  25.00 °C.
Refractive Index: 1.48800 @  20.00 °C.
Boiling Point: 268.00 to  272.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.005000 mm/Hg @ 25.00 °C. (est)
Flash Point: > 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 3.671 (est)
Soluble in:
 alcohol
 water, 16.47 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: fruity
 
Odor Strength: medium
 
 sweet  fruity  rummy  apricot  
Odor Description:
at 100.00 %. 
sweet fruity rum apricot
 
 
Flavor Type: spicy
 
 spicy  peppery  pepper black pepper  vegetable  
Taste Description:
spicy black pepper vegetable
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Beijing Lys Chemicals
2-Phenyl-1-propyl butyrate
BOC Sciences
For experimental / research use only.
2-Phenylpropyl Butyrate 95%
Parchem
2-phenyl propyl butyrate
Penta International
2-PHENYLPROPYL BUTYRATE, Kosher
Sigma-Aldrich: Aldrich
For experimental / research use only.
2-Phenylpropyl Butyrate 98%
Synerzine
2-Phenylpropyl Butyrate
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Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
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.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for 2-phenyl propyl butyrate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.0034 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.50 (μg/capita/day)
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: -2.00000
beverages(nonalcoholic): -1.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -1.00000
fruit ices: -1.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -2.00000
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:
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):
Flavouring Group Evaluation 55 (FGE.55): Consideration of phenyl-substituted aliphatic alcohols and related aldehydes and esters evaluated by JECFA (63rd meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and aryl-substituted saturated and unsaturated primary alcohol/aldehyde/acid/ester derivatives evaluated by EFSA in FGE.15 (2005) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 576263
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 2-phenylpropyl butanoate
Chemidplus: 0080866837
 [(2R)-2-phenylpropyl] butanoate
 [(2S)-2-phenylpropyl] butanoate
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References:
 2-phenylpropyl butanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 80866-83-7
Pubchem (cid): 576263
Pubchem (sid): 10393788
Pherobase: View
 [(2R)-2-phenylpropyl] butanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 80866-83-7
Pubchem (cid): 7058090
Pubchem (sid): 43647337
 [(2S)-2-phenylpropyl] butanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 80866-83-7
Pubchem (cid): 7017232
Pubchem (sid): 43613801
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS): View
HMDB (The Human Metabolome Database): HMDB34469
FooDB: FDB012879
Export Tariff Code: 2915.60.0000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
balsamic
balsamic
isoamyl pyruvateFL/FR
3-phenyl propyl cinnamateFL/FR
caramellic
 ethyl cyclopentenoloneFL/FR
 maltyl isobutyrateFL/FR
ethereal
 decyl propionateFL/FR
 ethyl nitrite 
 ethyl pyruvateFL/FR
1-hexen-3-olFL/FR
(E)-methyl tiglateFL/FR
 propyl formateFL/FR
fermented
isobutyl decanoateFL/FR
 ethyl (E)-2-crotonateFL/FR
 ethyl crotonateFL/FR
floral
 butyl nonanoateFL/FR
 citronellyl formateFL/FR
 ethyl hydrocinnamateFL/FR
 geranyl isobutyrateFL/FR
 heptyl propionateFL/FR
 jasmin lactone (IFF)FL/FR
 linalyl propionateFL/FR
 phenethyl acetateFL/FR
 phenethyl heptanoateFL/FR
 phenethyl isovalerateFL/FR
1-phenyl propyl butyrateFL/FR
 allyl hexanoateFL/FR
 allyl propionateFL/FR
isoamyl butyrateFL/FR
 amyl isobutyrateFL/FR
isoamyl isobutyrateFL/FR
isoamyl nonanoateFL/FR
 amyl propionateFL/FR
 apricot isobutyrateFR
 benzyl butyrateFL/FR
 benzyl heptanoateFL/FR
 berry pentadienoateFL/FR
 butyl 2-decenoateFL/FR
isobutyl butyrateFL/FR
 butyl formateFL/FR
 cyclohexanone diethyl acetalFL/FR
 decen-1-yl cyclopentanoneFL/FR
alpha,alpha-dimethyl benzyl isobutyrateFL/FR
 ethyl (E)-3-hexenoateFL/FR
 ethyl 2-hexenoateFL/FR
 ethyl heptanoateFL/FR
 ethyl propionateFL/FR
 fruity carboxylateFR
 fruity cyclopentanoneFR
 geranyl methyl tiglate 
 heptyl isobutyrateFL/FR
3-hexanoneFL/FR
 linalyl valerateFL/FR
 methyl propionateFL/FR
 peach cyclopentanoneFR
 prenyl formateFL/FR
 propyl butyrateFL/FR
 propyl isobutyrateFL/FR
 styryl acetateFL/FR
 tetrahydrofurfuryl acetateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
 benzyl hexanoateFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal dimethyl acetalFL/FR
 heptyl acetateFL/FR
(E)-2-hexen-1-yl formateFL/FR
(E)-2-hexen-1-yl phenyl acetateFL/FR
herbal
 linalyl isovalerateFL/FR
 viridiflorolFL/FR
honey
 allyl phenyl acetateFL/FR
 propyl phenyl acetateFL/FR
jammy
 ethyl 2-methyl-2-pentenoateFR
peppery
1,5-dimethyl-3-n-propyl-2-oxabicyclo(2.2.2)octane 
spicy
 caryophylleneFL/FR
beta-caryophylleneFL/FR
1,5-dimethyl-3-n-pentyl-2-oxabicyclo(2.2.2)octane 
sulfurous
 buchu mercaptanFL/FR
 cassis pentanoneFL/FR
 passiflora acetateFL/FR
waxy
 ethyl nonanoateFL/FR
 ethyl octanoateFL/FR
 
For Flavor
 
No flavor group found for these
 allyl cyclohexyl valerateFL
 amyl isobutyrateFL/FR
 amyl propionateFL/FR
isoamyl pyruvateFL/FR
 benzyl heptanoateFL/FR
 benzyl hexanoateFL/FR
isobutyl decanoateFL/FR
 butyl formateFL/FR
 butyl nonanoateFL/FR
 cyclohexanone diethyl acetalFL/FR
 decyl propionateFL/FR
 ethyl 2-hexenoateFL/FR
 ethyl hydrocinnamateFL/FR
 ethyl nitrite 
(E)-2-hexen-1-yl phenyl acetateFL/FR
 jasmin lactone (IFF)FL/FR
 linalyl valerateFL/FR
(E)-methyl tiglateFL/FR
 phenethyl heptanoateFL/FR
1-phenyl propyl butyrateFL/FR
 prenyl formateFL/FR
 styryl acetateFL/FR
 viridiflorolFL/FR
alliaceous
 allyl propionateFL/FR
berry
 heptyl isobutyrateFL/FR
brown
 tetrahydrofurfuryl acetateFL/FR
caramellic
 pyruvaldehydeFL
creamy
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
earthy
1-hexen-3-yl acetateFL
floral
 geranyl isobutyrateFL/FR
fruity
 allyl hexanoateFL/FR
isoamyl isobutyrateFL/FR
 benzyl butyrateFL/FR
 berry pentadienoateFL/FR
 butyl 2-decenoateFL/FR
isobutyl butyrateFL/FR
 citronellyl formateFL/FR
 decen-1-yl cyclopentanoneFL/FR
alpha,alpha-dimethyl benzyl isobutyrateFL/FR
 ethyl (E)-3-hexenoateFL/FR
 ethyl heptanoateFL/FR
 ethyl propionateFL/FR
2-furyl pentyl ketoneFL
 geranyl methyl tiglate 
 heptyl propionateFL/FR
3-hexanoneFL/FR
 linalyl isovalerateFL/FR
 methyl propionateFL/FR
 phenethyl isovalerateFL/FR
 propyl butyrateFL/FR
 propyl formateFL/FR
 propyl isobutyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
green
 cassis pentanoneFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal dimethyl acetalFL/FR
 heptyl acetateFL/FR
1-hexen-3-olFL/FR
herbal
 linalyl propionateFL/FR
honey
 allyl phenyl acetateFL/FR
 phenethyl acetateFL/FR
 propyl phenyl acetateFL/FR
jammy
 ethyl cyclopentenoloneFL/FR
 maltyl isobutyrateFL/FR
musty
 ethyl (E)-2-crotonateFL/FR
peppery
1,5-dimethyl-3-n-propyl-2-oxabicyclo(2.2.2)octane 
rummy
 ethyl crotonateFL/FR
 ethyl pyruvateFL/FR
(E)-2-hexen-1-yl formateFL/FR
spicy
beta-caryophylleneFL/FR
 caryophylleneFL/FR
 chipotle chili distillatesFL
 chipotle chili oleoresinFL
1,5-dimethyl-3-n-pentyl-2-oxabicyclo(2.2.2)octane 
 jalapeno oleoresinFL
3-phenyl propyl cinnamateFL/FR
sulfurous
 buchu mercaptanFL/FR
 methyl 2-(methyl thio) butyrateFL
 methyl thiomethyl butyrateFL
tropical
 passiflora acetateFL/FR
waxy
isoamyl butyrateFL/FR
 ethyl nonanoateFL/FR
 ethyl octanoateFL/FR
winey
isoamyl nonanoateFL/FR
 
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Potential Uses:
 apricotFR
 hyacinth jacintheFR
 jasminFR
 mangoFR
 peachFR
 plumFR
 roseFR
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Occurrence (nature, food, other): note
 found in nature
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Synonyms:
 butanoic acid 2-phenyl propyl ester
 butanoic acid, 2-phenylpropyl ester
 butyric acid 2-phenylpropyl ester
 hydratropyl butyrate
beta-methyl phenethyl butyrate
beta-methylphenethyl butyrate
alpha-phenyl propyl alcohol butyric ester
2-phenyl propyl butanoate
2-phenyl-1-propyl butyrate
a-phenylpropyl alcohol butyric ester
2-phenylpropyl butanoate
2-phenylpropyl butyrate
2-phenylpropyl n-butyrate
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