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

octyl benzoate
benzoic acid, octyl ester

Supplier Sponsors

Name:octyl benzoate
CAS Number: 94-50-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:202-339-1
FDA UNII:8JQ9R1SYRZ
Nikkaji Web:J167.507I
XlogP3:5.70 (est)
Molecular Weight:234.33874000
Formula:C15 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
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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.96790 @ 15.00 °C.
Boiling Point: 305.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000312 mmHg @ 25.00 °C. (est)
Flash Point: 275.00 °F. TCC ( 135.00 °C. )
logP (o/w): 5.691 (est)
Soluble in:
 alcohol
 water, 0.9178 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: balsamic
Odor Strength:medium
fruity balsamic
Odor Description:at 100.00 %. fruity balsam
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Octyl Benzoate
Santa Cruz Biotechnology
For experimental / research use only.
Octyl Benzoate
 
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for octyl benzoate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
Recommendation for octyl benzoate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):94-50-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :66751
National Institute of Allergy and Infectious Diseases:Data
octyl benzoate
Chemidplus:0000094508
 
References:
 octyl benzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:94-50-8
Pubchem (cid):66751
Pubchem (sid):135025240
Pherobase:View
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
FooDB:FDB020015
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
lycopene
CS
acidic
acidic
2-
methyl-2-pentenoic acid
FL/FR
alcoholic
fusel oil
FL/FR
anisic
amyl furoate
FL/FR
balsamic
butyl benzoate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl butyrate
FL/FR
cinnamyl formate
FL/FR
ethyl cinnamate
FL/FR
fir carboxylate
FR
hexyl cinnamate
FR
alpha-
methyl cinnamyl alcohol
FR
phenyl salicylate
FR
prenyl benzoate
FL/FR
terpinyl butyrate
FL/FR
caramellic
diethyl malate
FL/FR
fatty
hexyl pivalate
FR
floral
alpha-
amyl cinnamaldehyde
FL/FR
alpha-
amyl cinnamyl acetate
FL/FR
anise indene
FR
benzyl acetone
FL/FR
boronia absolute
FL/FR
geranyl tiglate
FL/FR
beta-
ionone
FL/FR
menthadienyl formate
FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
N-
methyl ionone
FR
alpha-iso
methyl ionone (90% min.)
FL/FR
petitgrain lemon oil
FL/FR
fruity
dihydroactinidolide
FL/FR
green acetate
FR
linalool oxide acetates
FL/FR
para-
menth-1-ene-9-ol
FL/FR
3-
phenyl propyl isobutyrate
FL/FR
herbal
iso
amyl heptanoate
FL/FR
buchu mercaptan acetate
FL/FR
butyl levulinate
FL/FR
chamomile valerate
FR
coriander oleoresin
FL/FR
cuminyl acetate
FL/FR
herbal undecanone
FR
linalyl octanoate
FL/FR
1-para-
menthen-9-yl acetate
FL/FR
methyl cyclogeranate (Firmenich)
FR
nonisyl acetate
FR
3-
octanon-1-ol
FL/FR
tricyclodecenyl propionate
FR
orris
orris capronate
FL/FR
spicy
cinnamyl propionate
FL/FR
clove bud oil
FL/FR
N,N-
diethyl octanamide
FR
(E)-
propyl 2-furan acrylate
FL/FR
spicy acetoacetate
FL/FR
woody
2-
decalinyl acetate
FR
patchouli absolute
FR
santalyl butyrate
FL/FR
For Flavor
No flavor group found for these
amyl furoate
FL/FR
butyl benzoate
FL/FR
cuminyl acetate
FL/FR
diethyl malate
FL/FR
dihydroactinidolide
FL/FR
linalool oxide acetates
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
3-
octanon-1-ol
FL/FR
prenyl benzoate
FL/FR
santalyl butyrate
FL/FR
acidic
acidic
(E)-2-
hexenoic acid
FL
balsamic
iso
butyl cinnamate
FL/FR
ethyl cinnamate
FL/FR
citrus
petitgrain lemon oil
FL/FR
earthy
alpha-
amyl cinnamyl acetate
FL/FR
floral
cinnamyl propionate
FL/FR
geranyl tiglate
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
terpinyl butyrate
FL/FR
fruity
benzyl acetone
FL/FR
boronia absolute
FL/FR
buchu mercaptan acetate
FL/FR
fusel oil
FL/FR
linalyl octanoate
FL/FR
1-para-
menthen-9-yl acetate
FL/FR
3-
phenyl propyl isobutyrate
FL/FR
(E)-
propyl 2-furan acrylate
FL/FR
herbal
iso
amyl heptanoate
FL/FR
butyl levulinate
FL/FR
coriander oleoresin
FL/FR
para-
menth-1-ene-9-ol
FL/FR
orris
orris capronate
FL/FR
sour
2-
methyl-2-pentenoic acid
FL/FR
spicy
cinnamyl formate
FL/FR
clove bud oil
FL/FR
spicy acetoacetate
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
winey
cinnamyl butyrate
FL/FR
woody
beta-
ionone
FL/FR
 
Potential Uses:
FRbalsam
FRchypre
FRfern
 fixer
FRoriental
FRwoody
 
Occurrence (nature, food, other):note
 lemon balm plant
Search Trop Picture
 not found in nature
 
Synonyms:
 benzoic acid octyl ester
 benzoic acid, octyl ester
N-octyl benzoate
 
 
Notes:
None found
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