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Details

Stereochemistry RACEMIC
Molecular Formula C13H18O2
Molecular Weight 206.2808
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PHENYLPROPYL ISOBUTYRATE

SMILES

CC(C)C(=O)OCC(C)C1=CC=CC=C1

InChI

InChIKey=LZTCJUAHYXNKRE-UHFFFAOYSA-N
InChI=1S/C13H18O2/c1-10(2)13(14)15-9-11(3)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H18O2
Molecular Weight 206.2808
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 22:09:51 GMT 2023
Edited
by admin
on Fri Dec 15 22:09:51 GMT 2023
Record UNII
3H4JM1983E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PHENYLPROPYL ISOBUTYRATE
FHFI  
Systematic Name English
HYDRATROPYL ISOBUTYRATE
Systematic Name English
HYDRATROPYL 2-METHYLPROPANOATE
Systematic Name English
2-PHENYLPROPYL ISOBUTYRATE [FHFI]
Common Name English
PROPANOIC ACID, 2-METHYL-, 2-PHENYLPROPYL ESTER
Common Name English
FEMA NO. 2892
Code English
2-PHENYLPROPYL 2-METHYLPROPANOATE
Systematic Name English
.BETA.-METHYLPHENETHYL ISOBUTYRATE
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
JECFA EVALUATION 2-PHENYLPROPYL ISOBUTYRATE
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID30867183
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY
FDA UNII
3H4JM1983E
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY
CAS
65813-53-8
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY
PUBCHEM
576240
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY
ECHA (EC/EINECS)
265-931-9
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY
JECFA MONOGRAPH
1458
Created by admin on Fri Dec 15 22:09:51 GMT 2023 , Edited by admin on Fri Dec 15 22:09:51 GMT 2023
PRIMARY