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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O2
Molecular Weight 150.1745
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZYL ACETATE

SMILES

CC(=O)OCC1=CC=CC=C1

InChI

InChIKey=QUKGYYKBILRGFE-UHFFFAOYSA-N
InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3

HIDE SMILES / InChI
Molecular Formula C9H10O2
Molecular Weight 150.1745
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Benzyl acetate is used as a fragrance ingredient and occurs in different plants and fruits, e.g., jasmine, apple, tea, plum, wine grape. It possesses a sweet and pleasant aroma, owing to which, it finds applications in personal hygiene and health care products.

Approval Year

2012
595
PubMed

PubMed

TitleDatePubMed
Glycine modulates the toxicity of benzyl acetate in F344 rats.
1998 May-Jun
Thresholds of carcinogenicity of flavors.
2002 Aug
Improved hardware and software for quick gas chromatography-olfactometry using CHARM and GC-"SNIF" analysis.
2002 May 15
Palladium(0)-catalyzed coupling-cyclization reaction of polymer-supported aryl iodides with 1,2-allenyl carboxylic acids. Solid-phase parallel synthesis of butenolides.
2002 May-Jun
Flavor release and rheology behavior of strawberry fatfree stirred yogurt during storage.
2004 May 19
An Eu(III) sensor based on N,N-diethyl-N-(4-hydroxy-6-methylpyridin-2-yl)guanidine.
2004 Oct
One-step synthesis of benzyl acetate by gas phase acetoxylation of toluene over highly active and selective Pd-Sb-TiO2 catalysts.
2004 Sep 21
Rapid determination of volatile compounds emitted from Chimonanthus praecox flowers by HS-SPME-GC-MS.
2004 Sep-Oct
Floral scent emission and pollinator attraction in two species of Gymnadenia (Orchidaceae).
2005 Feb
Generation of phenylpropanoid pathway-derived volatiles in transgenic plants: rose alcohol acetyltransferase produces phenylethyl acetate and benzyl acetate in petunia flowers.
2006 Mar
Electroanalytical performance of a terbium(III)-selective sensor based on a neutral ionophore in environmental and medicinal samples.
2008 Apr
Vinegar classification based on feature extraction and selection from headspace solid-phase microextraction/gas chromatography volatile analyses: a feasibility study.
2008 Feb 4
Antibacterial potential assessment of jasmine essential oil against e. Coli.
2008 Mar-Apr
Transesterification of primary and secondary alcohols using Pseudomonas aeruginosa lipase.
2008 May
Evaluation of the glycoside hydrolase activity of a Brettanomyces strain on glycosides from sour cherry (Prunus cerasus L.) used in the production of special fruit beers.
2008 Nov
New analogues of the BODIPY dye PM597: photophysical and lasing properties in liquid solutions and in solid polymeric matrices.
2009 Jul 16
Identification of host attractants for the ethiopian fruit fly, Dacus ciliatus loew.
2009 May
Acaricidal activity of eugenol based compounds against scabies mites.
2010 Aug 11
Selective retardation of perfume oil evaporation from oil-in-water emulsions stabilized by either surfactant or nanoparticles.
2010 Dec 7
Indoor air in beauty salons and occupational health exposure of cosmetologists to chemical substances.
2010 Jan
Sequencing around 5-hydroxyconiferyl alcohol-derived units in caffeic acid O-methyltransferase-deficient poplar lignins.
2010 Jun
Semantic knowledge influences prewired hedonic responses to odors.
2010 Nov 8
Patents

Patents

JP1085945A
1
JP2000066420A
1
JP2000143557A
1
JP2000204361A
1
JP2001519237A
1
JP2002177776A
1
JP2002205921A
1
JP2002524436A
1
JP2003081915A
1
JP2003517505A
1
JP2003519140A
1
JP2003532556A
4
JP2004035701A
1
JP2004099646A
1
JP2004200348A
1
JP2004516375A
1
JP2005261428A
1
JP2006517997A
1
JP2007500148A
7
JP2007500150A
28
JP2007518846A
1
JP2007538079A
1
JP2008539007A
1
JP2009120581A
1
JP2009502915A
1
JP2009530379A
1
JP2010119339A
1
JP2010261038A
1
JP2011001554A
1
JP2011105771A
1
JP2012500798A
1
JP2013537463A
1
JP4658326B2
1
JP4809531B2
1
JPH00288649A
1
JPH01197644A
1
JPH01221332A
1
JPH01301730A
1
JPH01315437A
1
JPH02134387A
1
JPH03106972A
1
JPH03109338A
1
JPH03271237A
1
JPH0399072A
1
JPH039999A
1
JPH04234826A
2
JPH0446130A
1
JPH05139907A
6
JPH05144570A
1
JPH05269369A
1
JPH07188344A
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:47:12 UTC 2023
Edited
by admin
on Fri Dec 15 16:47:12 UTC 2023
Record UNII
0ECG3V79ZJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYL ACETATE
FCC   FHFI   HSDB   INCI   MI   VANDF  
INCI  
Official Name English
PHENYLMETHYL ACETATE
Systematic Name English
NSC-4550
Code English
BENZYL ACETATE [FHFI]
Common Name English
FEMA NO. 2135
Code English
NCI-C06508
Common Name English
BENZYL ACETATE [VANDF]
Common Name English
BENZYL ACETATE [FCC]
Common Name English
BENZYL ETHANOATE
Systematic Name English
PHENYLMETHYL ETHANOATE
Systematic Name English
BENZYL ACETATE [IARC]
Common Name English
ACETIC ACID, PHENYLMETHYL ESTER
Common Name English
BENZYL ACETATE [HSDB]
Common Name English
BENZYL ACETATE [MI]
Common Name English
BENZYL ACETATE [INCI]
Common Name English
ACETIC ACID, BENZYL ESTER
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
JECFA EVALUATION BENZYL ACETATE
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID0020151
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
EVMPD
SUB59508
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
WIKIPEDIA
BENZYL ACETATE
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
CAS
140-11-4
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
NSC
4550
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
RXCUI
1487188
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY RxNorm
MESH
C046412
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
MERCK INDEX
m2396
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY Merck Index
SMS_ID
100000134071
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
FDA UNII
0ECG3V79ZJ
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
PUBCHEM
8785
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
ECHA (EC/EINECS)
205-399-7
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
JECFA MONOGRAPH
318
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
CHEBI
52051
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
DAILYMED
0ECG3V79ZJ
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
HSDB
2851
Created by admin on Fri Dec 15 16:47:12 UTC 2023 , Edited by admin on Fri Dec 15 16:47:12 UTC 2023
PRIMARY
NIH
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