geranyl crotonate
trans-3,7-dimethyl-2,6-octadien-1-ol 2-butenoate
 
Notes:
None found
  • Penta International
    • Penta International Corporation
      Chemistry innovation
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  • SRS Aromatics
    • SRS Aromatics Ltd
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  • Synerzine
    • Synerzine, Inc.
      Innovation. Customization. Aroma Ingredients.
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      W070 GERANYL CROTONATE
       
Synonyms   Articles   Notes   Search
CAS Number: 56172-46-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 260-027-0
Nikkaji Web: J65.642I
XlogP3-AA: 4.30 (est)
Molecular Weight: 222.32774000
Formula: C14 H22 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 98.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 302.00 to  303.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 292.00 °F. TCC ( 144.44 °C. )
logP (o/w): 4.471 (est)
Soluble in:
 alcohol
 water, 1.115 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
allyl crotonate
isoamyl crotonate
apple crotonate
benzyl crotonate
butyl (E)-2-crotonate
citronellyl crotonate
cyclohexyl crotonate
dimethyl benzyl carbinyl crotonate
ethyl (E)-2-crotonate
ethyl crotonate
fig crotonate
heptyl crotonate
(Z)-3-hexen-1-yl (E)-crotonate
(E)-3-hexen-1-yl crotonate
hexyl (E)-crotonate
octyl crotonate
phenethyl crotonate
3-phenyl propyl crotonate
plum crotonate
isopropyl (E)-crotonate
propyl crotonate
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Organoleptic Properties:
 
Odor Type: caramellic
 
Odor Strength: medium
 
Substantivity: 51 hour(s) at 100.00 %
 
 sweet  caramellic  maple  fruity  almond  acorn  nutty  
Odor Description:
at 100.00 %. 
sweet caramel maple fruity almond acorns nutty
Luebke, William tgsc, (1984)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Grau Aromatics
GERANYL-CROTONATE
Penta International
GERANYL CROTONATE
SRS Aromatics
GERANYL CROTONATE
Synerzine
GERANYL CROTONATE
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Safety Information:
 
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:
oral-rat LD50  > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 891, 1974.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 891, 1974.

Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for geranyl crotonate usage levels up to:
  10.0000 % in the fragrance concentrate.
 
Recommendation for geranyl crotonate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 56172-46-4
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 5980396
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 [(2E)-3,7-dimethylocta-2,6-dienyl] (E)-but-2-enoate
Chemidplus: 0056172464
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References:
 [(2E)-3,7-dimethylocta-2,6-dienyl] (E)-but-2-enoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 56172-46-4
Pubchem (cid): 5980396
Pubchem (sid): 135003725
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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
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2916.19.7000
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
acidic
 cyclohexyl acetic acidFL/FR
balsamic
2-acetyl furanFL/FR
buttery
 acetoinFL/FR
 acetyl propionylFL/FR
3,4-hexane dioneFL/FR
2-oxobutyric acidFL/FR
 caramel furanone solutionFL/FR
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
alpha,alpha-dimethyl anisyl acetoneFL/FR
 ethyl 2-hydroxy-2-methyl butyrateFL/FR
 ethyl cyclopentenoloneFL/FR
 ethyl maltolFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 fenugreek absoluteFL/FR
 fenugreek oleoresinFL/FR
 immortelle absoluteFL/FR
 levulinic acidFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
 menthone lactoneFL/FR
 mesitene lactoneFR
5-methyl furfuralFL/FR
 rosefuranFL/FR
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 strawberry furanone acetateFL/FR
 toffee furanoneFL/FR
coconut
gamma-heptalactoneFL/FR
coumarinic
 tonka bean resinoidFR
creamy
gamma-butyrolactoneFL/FR
ethereal
 ethyl 4-pentenoateFL/FR
 ethyl pyruvateFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
fermented
 ethyl (E)-2-crotonateFL/FR
fruity
 apricot almond fragranceFR
 cinnamyl isobutyrateFL/FR
(E)-ethyl tiglateFL/FR
 tetrahydrofurfuryl acetateFL/FR
green
isoamyl 3-(2-furan) propionateFL/FR
herbal
 acorn acetateFR
 butyl levulinateFL/FR
3-propylidene phthalideFL/FR
moldy
 strawberry furanone methyl etherFL/FR
musty
3-acetyl-2,5-dimethyl furanFL/FR
nutty
2-acetyl-3,5(or 6)-dimethyl pyrazineFL/FR
1,2-cyclohexane dioneFL/FR
2,3-dimethyl pyrazineFL/FR
2-methyl-3-(methyl thio) pyrazineFL/FR
 nutty cyclohexenoneFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
 fenugreek resinoidFL/FR
(E)-tiglic acidFL/FR
sweet
2-hydroxy-3,4,5-trimethyl-2-cyclopenten-1-oneFL/FR
 vanilla oleoresin baliFL/FR
tonka
 tonka bean absoluteFR
vanilla
 ethyl vanillinFL/FR
 vanillyl isobutyrateFL/FR
vegetable
 tetrahydrofurfuryl alcoholFL/FR
 
For Flavor
 
No flavor group found for these
2-acetyl-3,4,5,6-tetrahydropyridineFL
 allyl 2-furoateFL
 benzyl disulfideFL
1,2-cyclohexane dioneFL/FR
2,5-diethyl tetrahydrofuranFL
alpha,alpha-dimethyl anisyl acetoneFL/FR
 ethyl 2-hydroxy-2-methyl butyrateFL/FR
 ethyl 4-pentenoateFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 furfuryl acetoneFL
2-hydroxy-3,4,5-trimethyl-2-cyclopenten-1-oneFL/FR
 menthone lactoneFL/FR
2-methyl-3-(methyl thio) pyrazineFL/FR
 rosefuranFL/FR
isoamyl 3-(2-furan) propionateFL/FR
acidic
 levulinic acidFL/FR
bready
 mango furanoneFL
brown
2-oxobutyric acidFL/FR
 fenugreek oleoresinFL/FR
5-methyl furfuralFL/FR
 tetrahydrofurfuryl acetateFL/FR
(E)-tiglic acidFL/FR
burnt
 furfuryl alcoholFL
buttery
 diacetylFL
3,4-hexane dioneFL/FR
caramellic
 caramel dioneFL
 caramel furanoneFL
 caramel furanone solutionFL/FR
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
 ethyl maltolFL/FR
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-oneFL
 fenugreek absoluteFL/FR
 fenugreek resinoidFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
3-methyl butyl 2-furyl butyrateFL
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 strawberry furanone acetateFL/FR
 toffee furanoneFL/FR
coffee
2-thiophene thiolFL
creamy
 acetoinFL/FR
fatty
2,4-undecadienalFL
(E,E)-2,4-undecadienalFL
fruity
 cinnamyl isobutyrateFL/FR
(E)-ethyl tiglateFL/FR
 furfuryl valerateFL
2,4-hexadien-1-olFL
2-pentanoyl furanFL
isovaleraldehyde propylene glycol acetalFL/FR
green
 immortelle absoluteFL/FR
3-propylidene phthalideFL/FR
herbal
 butyl levulinateFL/FR
5-hydroxymethyl furfuralFL
jammy
 ethyl cyclopentenoloneFL/FR
lactonic
gamma-heptalactoneFL/FR
milky
gamma-butyrolactoneFL/FR
moldy
 strawberry furanone methyl etherFL/FR
musty
 ethyl (E)-2-crotonateFL/FR
nutty
2-acetyl furanFL/FR
3-acetyl-2,5-dimethyl furanFL/FR
2-acetyl-3,5(or 6)-dimethyl pyrazineFL/FR
2,3-dimethyl pyrazineFL/FR
 nutty cyclohexenoneFL/FR
 peanut oxazoleFL
 tetrahydrofurfuryl alcoholFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
rummy
 ethyl pyruvateFL/FR
sweet
 cyclohexyl acetic acidFL/FR
 vanilla oleoresin baliFL/FR
toasted
 acetyl propionylFL/FR
vanilla
 ethyl vanillinFL/FR
 vanillyl isobutyrateFL/FR
waxy
 furfuryl octanoateFL
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 acornFR
 autumnFR
 caramelFL
 herbalFR
 mapleFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
2-butenoic acid 3,7-dimethyl-2,6-octadienyl ester
2-butenoic acid, (2E)-3,7-dimethyl-2,6-octadienyl ester
 crotonic acid geraniol ester
((2E)-3,7-dimethyl octa-2,6-dienyl) (E)-but-2-enoate
3,7-dimethyl-2-trans, 6-octadienyl crotonate
trans-3,7-dimethyl-2,6-octadien-1-ol 2-butenoate
trans-3,7-dimethyl-2,6-octadien-1-ol, 2-butenoate
(E,E)-3,7-dimethyl-2,6-octadienyl 2-butenoate
(E)-3,7-dimethyl-2,6-octadienyl 2-butenoate
trans-3,7-dimethyl-2,6-octadienyl 2-butenoate
[(2E)-3,7-dimethylocta-2,6-dienyl] (E)-but-2-enoate
(E)-geranyl crotonate
 geranyl-2-butenoate
(E)-neryl crotonate
2,6-octadien-1-ol, 3,7-dimethyl-, 2-butenoate, (E)-
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