EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

cuminyl acetate
4-isopropylbenzyl acetate

Sponsors

Name:(4-propan-2-ylphenyl)methyl acetate
CAS Number: 59230-57-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:261-671-5
Nikkaji Web:J60.247G
Beilstein Number:1950785
MDL:MFCD00026412
XlogP3:3.20 (est)
Molecular Weight:192.25792000
Formula:C12 H16 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
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
FLAVIS Number:09.611 (Old)
DG SANTE Food Flavourings:09.611 4-isopropylbenzyl acetate
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity:0.99800 to 1.00400 @ 25.00 °C.
Pounds per Gallon - (est).: 8.304 to 8.354
Specific Gravity:0.99300 to 1.00100 @ 20.00 °C.
Pounds per Gallon - est.: 8.272 to 8.339
Refractive Index:1.49400 to 1.50000 @ 20.00 °C.
Boiling Point: 250.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.018000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.292 (est)
Soluble in:
 alcohol
 water, 45.68 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: herbal
fresh fruity sweet herbal bergamot
Odor Description:at 100.00 %. fresh fruity sweet herbal bergamot
Luebke, William tgsc, (1992)
Odor sample from: International Flavors & Fragrances Inc.
Odor and/or flavor descriptions from others (if found).
IFF
Cuminyl Acetate
Odor Description:fresh fruity sweet herbal bergamot
Tadimety Aromatics
Cuminyl Acetate
Odor Description:Spicy, Green, Cuminic
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Augustus Oils
Cuminyl Acetate
Services
Azelis UK
CUMINYL ACET
Services
BOC Sciences
For experimental / research use only.
Acetic acid 4-isopropylbenzyl ester
CG Herbals
Cuminyl Acetate
IFF
Cuminyl Acetate
Odor: fresh fruity sweet herbal bergamot
M&U International
Cuminyl Acetate
Penta International
CUMINYL ACETATE
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-isoPropylbenzyl Acetate
Tadimety Aromatics
Cuminyl Acetate
Odor: Spicy, Green, Cuminic
The John D. Walsh Company
Cuminyl Acetate
Treatt
Cuminyl Acetate
 
Safety Information:
Preferred SDS: View
 
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 1450 mg/kg
Food and Chemical Toxicology. Vol. 30, Pg. 57S, 1992.

Dermal Toxicity:
skin-rabbit LDLo 5000 mg/kg
Food and Chemical Toxicology. Vol. 30, Pg. 57S, 1992.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for cuminyl acetate usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.0000025.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
 
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):

Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) on a request from the Commission related to Flavouring Group Evaluation 20 (FGE.20): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 52 (FGE.52): Consideration of hydroxy- and alkoxy-substituted benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters evaluated by EFSA in FGE.20 (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

Flavouring Group Evaluation 54 (FGE.54)[1] - Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20 (2005) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Flavouring Group Evaluation 20, Revision 1 (FGE.20Rev1): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 54, Revision 1 (FGE.54Rev1): Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20Rev1 (2009)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 2 (FGE.20Rev2): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 3(FGE.20Rev3): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 4 (FGE.20Rev4): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):59230-57-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :100990
National Institute of Allergy and Infectious Diseases:Data
(4-propan-2-ylphenyl)methyl acetate
Chemidplus:0059230578
 
References:
 (4-propan-2-ylphenyl)methyl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:59230-57-8
Pubchem (cid):100990
Pubchem (sid):135058016
Pherobase:View
 
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:2915.39.9050
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
lily pentanal
FR
nonanal (aldehyde C-9)
FL/FR
animal
para-
cresyl isobutyrate
FL/FR
para-
cresyl phenyl acetate
FL/FR
anisic
amyl furoate
FL/FR
balsamic
linalyl cinnamate
FL/FR
camphoreous
2,6-
dimethyl-3-oxatricyclo(4.2.1.0*2,4*)nonane
FR
caramellic
diethyl malate
FL/FR
citrus
benzyl anthranilate
FR
bergamot acetoacetate
FR
citrus ocimenol
FR
dihydromyrcenyl acetate
FR
alpha-
methylene citronellal
FR
myrcenyl acetate
FL/FR
alpha-
terpinyl methyl ether
FL/FR
tetrahydromyrcenol
FR
tetrahydromyrcenyl acetate
FR
verbena absolute france
FL/FR
ethereal
ethyl 4-pentenoate
FL/FR
floral
alpha-
amyl cinnamaldehyde
FL/FR
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
benzyl acetate
FL/FR
benzyl acetone
FL/FR
bigarade oxide
FR
alpha-
butyl cinnamaldehyde
FL/FR
butyl tiglate
FR
cassis cyclohexene
FR
(S)-
citronellyl acetate
FL/FR
citronellyl ethoxalate
FR
citronellyl formate
FL/FR
para-
cresyl propionaldehyde
CS
cyclamen aldehyde / methyl anthranilate schiff's base
FR
cyclohexyl ethyl alcohol
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
ethyl linalool
FR
ethyl linalyl acetate
FR
(E,E)-
farnesol
FL/FR
freesia acetate
FR
gardenia decalone
FR
geranyl tiglate
FL/FR
hydroxycitronellal
FL/FR
hydroxycitronellal / methyl anthranilate schiff's base
FR
hydroxycitronellal diethyl acetal
FL/FR
hydroxycitronellal dimethyl acetal
FL/FR
hydroxycitronellol
FL/FR
leerall / methyl anthranilate schiff's base
FR
lily propanol
FR
lilyall / methyl anthranilate schiff's base
FR
linalyl benzoate
FL/FR
linalyl butyrate
FL/FR
linalyl propionate
FL/FR
magnolia decadienal
FR
menthadienyl formate
FR
methoxycitronellal
FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
2-
methyl octanal
FL/FR
muguet carbaldehyde
FR
muguet carbinol
FL/FR
muguet nitrile
FR
muguet octadienol
FR
muguet propanol
FR
muguet shiseol
FL/FR
neryl isovalerate
FL/FR
nonan-3-yl acetate
FL/FR
3-
nonanone
FL/FR
rose undecene
FR
surfleurs d'oranger oil
FL/FR
alpha-
terpinyl anthranilate
FL/FR
terpinyl isobutyrate
FL/FR
tetrahydrolinalool
FL/FR
tetrahydrolinalyl acetate
FR
(E)-2-
undecen-1-ol
FL/FR
ylang ylang flower oil
FL/FR
fruity
para-
anisyl propionate
FL/FR
1,4-
dimethyl bicyclo(3.2.1)octan-3-dioxolane
FR
ethyl (R)-2-hydroxy-4-methyl pentanoate
FR
ethyl (S)-2-hydroxy-4-methyl pentanoate
FR
hexyl acetate
FL/FR
linalyl isobutyrate
FL/FR
para-
menth-1-ene-9-ol
FL/FR
2-
methyl butyl isovalerate
FL/FR
nerolidyl isobutyrate
FR
ocimen-1-yl acetate
FR
green
iso
butyl heptanoate
FL/FR
butyl heptanoate
FL/FR
iso
butyl methyl ketone
FL/FR
cilantro leaf oil
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl tiglate
FL/FR
ivy carbaldehyde
FL/FR
2,4-
ivy carbaldehyde
FL/FR
3,5-
ivy carbaldehyde
FL/FR
3,6-
ivy carbaldehyde
FL/FR
laevo-
linalyl acetate
FL/FR
dextro-
linalyl acetate
FL/FR
(2-
methoxy-1-methyl butyl) benzene
FR
2,4,8-
trimethyl-5-oxatricyclo(6.2.1.0*2,6*)undecane
FR
herbal
6-
acetoxydihydrotheaspirane
FL/FR
iso
amyl heptanoate
FL/FR
bergamot mint herb oil
FR
buchu mercaptan acetate
FL/FR
butyl levulinate
FL/FR
chamomile propionate
FR
chamomile valerate
FR
clary octenone
FR
dimethyl benzyl carbinyl formate
FL/FR
cis-
herbal cyclohexane
FR
linalyl acetate
FL/FR
linalyl formate
FL/FR
linalyl isovalerate
FL/FR
linalyl octanoate
FL/FR
1-para-
menthen-9-yl acetate
FL/FR
methyl hexyl ether
FL/FR
(1S,5R)-
myrtenyl acetate
FL/FR
nopyl acetate
FR
3-
octanon-1-ol
FL/FR
3-
octyl acetate
FL/FR
petitgrain heptane
FR
rue oil
FL/FR
saffron pyranone
FR
terpineol acetate
FL/FR
alpha-
terpinyl acetate
FL/FR
tricyclodecenyl propionate
FR
viridiflorol
FL/FR
marine
ozone propanal
FR
orris
orris capronate
FL/FR
waxy
decanal dimethyl acetal
FL/FR
woody
alpha-
farnesene
FL/FR
For Flavor
No flavor group found for these
6-
acetoxydihydrotheaspirane
FL/FR
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
amyl furoate
FL/FR
para-
anisyl propionate
FL/FR
benzyl methyl tiglate
FL
iso
butyl heptanoate
FL/FR
decanal dimethyl acetal
FL/FR
diethyl malate
FL/FR
dimethyl benzyl carbinyl formate
FL/FR
ethyl 4-pentenoate
FL/FR
(E,E)-
farnesol
FL/FR
ivy carbaldehyde
FL/FR
3,5-
ivy carbaldehyde
FL/FR
dextro-
linalyl acetate
FL/FR
laevo-
linalyl acetate
FL/FR
linalyl formate
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
2-
methyl octanal
FL/FR
nonan-3-yl acetate
FL/FR
3-
octanon-1-ol
FL/FR
surfleurs d'oranger oil
FL/FR
terpineol acetate
FL/FR
alpha-
terpinyl anthranilate
FL/FR
terpinyl isobutyrate
FL/FR
(E)-2-
undecen-1-ol
FL/FR
viridiflorol
FL/FR
alpha-
butyl cinnamaldehyde
FL/FR
aldehydic
aldehydic
nonanal (aldehyde C-9)
FL/FR
aromatic
para-
cresyl isobutyrate
FL/FR
citrus
cilantro leaf oil
FL/FR
myrcenyl acetate
FL/FR
verbena absolute france
FL/FR
ethereal
methyl hexyl ether
FL/FR
floral
(S)-
citronellyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
geranyl tiglate
FL/FR
linalyl acetate
FL/FR
linalyl benzoate
FL/FR
linalyl butyrate
FL/FR
linalyl isobutyrate
FL/FR
muguet carbinol
FL/FR
muguet shiseol
FL/FR
tetrahydrolinalool
FL/FR
ylang ylang flower oil
FL/FR
fruity
benzyl acetate
FL/FR
benzyl acetone
FL/FR
buchu mercaptan acetate
FL/FR
butyl heptanoate
FL/FR
citronellyl formate
FL/FR
hexyl acetate
FL/FR
linalyl cinnamate
FL/FR
linalyl isovalerate
FL/FR
linalyl octanoate
FL/FR
1-para-
menthen-9-yl acetate
FL/FR
2-
methyl butyl isovalerate
FL/FR
neryl isovalerate
FL/FR
green
iso
butyl methyl ketone
FL/FR
cyclohexyl ethyl alcohol
FL/FR
alpha-
farnesene
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl tiglate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
3,6-
ivy carbaldehyde
FL/FR
3-
nonanone
FL/FR
3-
octyl acetate
FL/FR
herbal
iso
amyl heptanoate
FL/FR
butyl levulinate
FL/FR
linalyl propionate
FL/FR
para-
menth-1-ene-9-ol
FL/FR
rue oil
FL/FR
melon
hydroxycitronellal diethyl acetal
FL/FR
orris
orris capronate
FL/FR
phenolic
para-
cresyl phenyl acetate
FL/FR
powdery
hydroxycitronellol
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
waxy
hydroxycitronellal
FL/FR
hydroxycitronellal dimethyl acetal
FL/FR
woody
(1S,5R)-
myrtenyl acetate
FL/FR
alpha-
terpinyl acetate
FL/FR
alpha-
terpinyl methyl ether
FL/FR
 
Potential Uses:
FRbergamot
FRcumin oil replacer
FRfresh and clean
FRfruit
FRherbal
FRleather
FRspice
FRwoody
 
Occurrence (nature, food, other):note
 laurel leaf oil turkey @ <0.10%
Data GC Search Trop Picture
 
Synonyms:
 benzenemethanol, 4-(1-methylethyl)-, acetate
p-cumen-7-yl acetate
para-cumen-7-yl acetate
 cumin acetate
p-cymen-7-ol acetate
4-(1-methyl ethyl) benzene methanol acetate
4-(1-methylethyl) benzenemethanol acetate
4-(1-methylethyl)benzenemethanol acetate
4-(propan-2-yl)benzyl acetate
(4-propan-2-ylphenyl)methyl acetate
4-isopropyl benzyl acetate
p-isopropyl benzyl acetate
para-isopropyl benzyl acetate
4-isopropylbenzyl acetate
p-isopropylbenzyl acetate
para-isopropylbenzyl acetate
 
 
Notes:
None found
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