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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 Ethyl 4-phenylbutyrate

SMILES

CCOC(=O)CCCC1=CC=CC=C1

InChI

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

HIDE SMILES / InChI
Molecular Formula C12H16O2
Molecular Weight 192.2542
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:31:42 GMT 2025
Edited
by admin
on Mon Mar 31 19:31:42 GMT 2025
Record UNII
BU9R7P5U55
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 4-phenylbutyrate
FHFI  
Systematic Name English
FEMA NO. 2453
Preferred Name English
BENZENEBUTANOIC ACID, ETHYL ESTER
Common Name English
Ethyl 4-phenyl butyrate
Common Name English
NSC-163318
Code English
ETHYL 4-PHENYLBUTYRATE [FHFI]
Common Name English
ETHYL 4-PHENYLBUTANOATE
Systematic Name English
ETHYL .GAMMA.-PHENYLBUTYRATE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION ETHYL 4-PHENYLBUTYRATE
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
CFR 21 CFR 172.515
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
Code System Code Type Description
CAS
10031-93-3
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
FDA UNII
BU9R7P5U55
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID90143132
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
NSC
163318
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
JECFA MONOGRAPH
1446
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
PUBCHEM
61452
Created by admin on Mon Mar 31 19:31:42 GMT 2025 , Edited by admin on Mon Mar 31 19:31:42 GMT 2025
PRIMARY
NIH
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