apricot isobutyrate
propanoic acid, 2-methyl-, decahydro-2-naphthalenyl ester
 
Notes:
None found
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1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl 2-methylpropanoate (Click)
CAS Number: 67874-78-6Picture of molecule
ECHA EINECS - REACH Pre-Reg: 267-506-3
XlogP3-AA: 4.50 (est)
Molecular Weight: 224.34368000
Formula: C14 H24 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.97100 to 0.97900 @  25.00 °C.
Pounds per Gallon - (est).: 8.080 to  8.146
Specific Gravity: 0.97200 to 0.98000 @  20.00 °C.
Pounds per Gallon - est.: 8.097 to 8.164
Refractive Index: 1.48600 to 1.47200 @  20.00 °C.
Boiling Point: 271.00 to  272.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.006000 mm/Hg @ 25.00 °C. (est)
Flash Point: > 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 4.763 (est)
Soluble in:
 alcohol
 water, 4.065 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Type: fruity
Odor Strength: medium
 fruity  apricot  plum  rose  
Odor Description:
at 100.00 %. 
fruity mild apricot plum rose
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
 None found
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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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
Recommendation for apricot isobutyrate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for apricot isobutyrate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 67874-78-6
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 106937
National Institute of Allergy and Infectious Diseases: Data
 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl 2-methylpropanoate
Chemidplus: 0067874786
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References:
 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl 2-methylpropanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 67874-78-6
Pubchem (cid): 106937
Pubchem (sid): 135062894
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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
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2915.60.0000
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
balsamic
 ethyl cinnamateFL/FR
 guaiyl butyrateFR
3-phenyl propyl cinnamateFL/FR
caramellic
 maltyl isobutyrateFL/FR
fermented
isobutyl decanoateFL/FR
floral
 anise indeneFR
para-anisyl butyrateFL/FR
 benzyl isobutyrateFL/FR
 butyl nonanoateFL/FR
 cassis buteneoneFR
(S)-citronellyl acetateFL/FR
 citronellyl formateFL/FR
beta-damascenoneFL/FR
delta-damasconeFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 geranyl isobutyrateFL/FR
 geranyl propionateFL/FR
 heptyl propionateFL/FR
 jasmin lactone (IFF)FL/FR
 petitgrain mandarin oilFL/FR
 phenethyl acetateFL/FR
 phenethyl heptanoateFL/FR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
2-phenethyl valerateFL/FR
1-phenyl propyl butyrateFL/FR
 plum damasconeFR
 propyl salicylateFR
 rhodinyl butyrateFL/FR
 allyl isononylateFR
 allyl propionateFL/FR
isoamyl butyrateFL/FR
isoamyl isobutyrateFL/FR
 amyl isobutyrateFL/FR
isoamyl nonanoateFL/FR
 amyl propionateFL/FR
para-anisyl valerateFL/FR
 apple crotonateFR
 benzyl butyrateFL/FR
 benzyl heptanoateFL/FR
3-benzyl-4-heptanoneFL/FR
2-butanolFL/FR
 butyl 2-decenoateFL/FR
 butyl anthranilateFL/FR
 butyl formateFL/FR
(E)-beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
beta-damasconeFL/FR
 decen-1-yl cyclopentanoneFL/FR
 dihydroactinidolideFL/FR
alpha,alpha-dimethyl benzyl isobutyrateFL/FR
(R)-delta-dodecalactoneFL/FR
 ethyl 4-phenyl butyrateFL/FR
(E)-ethyl tiglateFL/FR
 fruity cyclopentanoneFR
 geranyl butyrateFL/FR
 geranyl methyl tiglate 
 heptyl isobutyrateFL/FR
 hexyl formateFL/FR
beta-ionyl ethyl etherFR
 linalyl valerateFL/FR
 octyl formateFL/FR
 peach cyclopentanoneFR
2-phenyl propyl butyrateFL/FR
3-phenyl propyl isovalerateFL/FR
 plum crotonateFR
 plum damascone (high alpha)FR
 propyl butyrateFL/FR
 propyl isobutyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
4-(para-tolyl)-2-butanoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
isoamyl formateFL/FR
 benzyl hexanoateFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal dimethyl acetalFL/FR
 heptyl acetateFL/FR
 heptyl formateFL/FR
 hexyl phenyl acetateFL/FR
herbal
 linalyl formateFL/FR
 linalyl isovalerateFL/FR
 viridiflorolFL/FR
 viridiflorolFL/FR
honey
 propyl phenyl acetateFL/FR
powdery
para-anisyl acetateFL/FR
sulfurous
 buchu mercaptanFL/FR
 cassis pentanoneFL/FR
 passiflora acetateFL/FR
waxy
 ethyl nonanoateFL/FR
 ethyl octanoateFL/FR
winey
 butyl angelateFL/FR
woody
 santalyl butyrateFL/FR
 
For Flavor
 
No flavor group found for these
 allyl cyclohexyl valerateFL
 amyl isobutyrateFL/FR
 amyl propionateFL/FR
para-anisyl valerateFL/FR
 benzyl heptanoateFL/FR
 benzyl hexanoateFL/FR
2-butanolFL/FR
 butyl angelateFL/FR
isobutyl decanoateFL/FR
 butyl formateFL/FR
 butyl nonanoateFL/FR
 dihydroactinidolideFL/FR
(R)-delta-dodecalactoneFL/FR
 ethyl 4-phenyl butyrateFL/FR
2-hexenalFL
 jasmin lactone (IFF)FL/FR
 linalyl formateFL/FR
 linalyl valerateFL/FR
 phenethyl heptanoateFL/FR
2-phenethyl valerateFL/FR
1-phenyl propyl butyrateFL/FR
3-phenyl propyl isovalerateFL/FR
 santalyl butyrateFL/FR
 viridiflorolFL/FR
 viridiflorolFL/FR
beta-damasconeFL/FR
alliaceous
 allyl propionateFL/FR
anisic
para-anisyl butyrateFL/FR
balsamic
 ethyl cinnamateFL/FR
berry
 heptyl isobutyrateFL/FR
citrus
 petitgrain mandarin oilFL/FR
creamy
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
fatty
 heptyl formateFL/FR
floral
(S)-citronellyl acetateFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 geranyl isobutyrateFL/FR
 rhodinyl butyrateFL/FR
fruity
isoamyl isobutyrateFL/FR
para-anisyl acetateFL/FR
 benzyl butyrateFL/FR
 benzyl isobutyrateFL/FR
3-benzyl-4-heptanoneFL/FR
 butyl 2-decenoateFL/FR
 butyl anthranilateFL/FR
 citronellyl formateFL/FR
(E)-beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
 decen-1-yl cyclopentanoneFL/FR
alpha,alpha-dimethyl benzyl isobutyrateFL/FR
(E)-ethyl tiglateFL/FR
2-furyl pentyl ketoneFL
 geranyl butyrateFL/FR
 geranyl methyl tiglate 
 heptyl propionateFL/FR
 hexyl phenyl acetateFL/FR
 linalyl isovalerateFL/FR
 methyl formateFL
 phenethyl isovalerateFL/FR
 propyl butyrateFL/FR
 propyl isobutyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
4-(para-tolyl)-2-butanoneFL/FR
green
isoamyl formateFL/FR
 cassis pentanoneFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal dimethyl acetalFL/FR
 heptyl acetateFL/FR
 hexyl formateFL/FR
 octyl formateFL/FR
honey
 phenethyl acetateFL/FR
 phenethyl isobutyrateFL/FR
 propyl phenyl acetateFL/FR
jammy
 maltyl isobutyrateFL/FR
spicy
2-phenyl propyl butyrateFL/FR
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
 geranyl propionateFL/FR
winey
isoamyl nonanoateFL/FR
beta-damascenoneFL/FR
delta-damasconeFL/FR
 
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Potential Uses:
 apricotFR
 fruitFR
 jasminFR
 plumFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 apricot isobutyrate
 decahydro-2-naphthyl isobutyrate
trans-decahydro-beta-naphthyl isobutyrate
 decahydronaphthalen-2-yl 2-methylpropanoate
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl 2-methylpropanoate
 decalin-2-yl 2-methyl propanoate
2-methyl propanoic acid decahydro-2-naphthalenyl ester
 propanoic acid, 2-methyl-, decahydro-2-naphthalenyl ester
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