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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O2
Molecular Weight 192.2542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PHENYLETHYL ISOBUTYRATE

SMILES

CC(C)C(=O)OCCC1=CC=CC=C1

InChI

InChIKey=JDQVBGQWADMTAM-UHFFFAOYSA-N
InChI=1S/C12H16O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Patents

Patents

JP2001233753A
4
Name Type Language
2-PHENYLETHYL ISOBUTYRATE
Systematic Name English
PHENETHYL ISOBUTYRATE [FCC]
Common Name English
ISOBUTYRIC ACID, PHENETHYL ESTER
Common Name English
2-PHENYLETHYL 2-METHYLPROPANOATE
Systematic Name English
PHENETHYL ISOBUTYRATE [FHFI]
Common Name English
.BETA.-PHENYLETHYL 2-METHYLPROPIONATE
Systematic Name English
FEMA NO. 2862
Code English
PROPANOIC ACID, 2-METHYL-, 2-PHENYLETHYL ESTER
Common Name English
PHENETHYL ISOBUTYRATE
FCC   FHFI  
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION PHENETHYL ISOBUTYRATE
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
Code System Code Type Description
PUBCHEM
7655
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
FDA UNII
QRZ4RE7DCL
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
CHEBI
87409
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-116-1
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
EVMPD
SUB126389
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
SMS_ID
100000151950
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
JECFA MONOGRAPH
925
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
CAS
103-48-0
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID7044764
Created by admin on Fri Dec 15 17:36:11 GMT 2023 , Edited by admin on Fri Dec 15 17:36:11 GMT 2023
PRIMARY
NIH
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