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Details

Stereochemistry MIXED
Molecular Formula C16H24O4
Molecular Weight 280.3594
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3-Dihydroxypropyl ?-methyl-4-(2-methylpropyl)benzeneacetate

SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)OCC(O)CO

InChI

InChIKey=UIMOFRMULCSFFF-UHFFFAOYSA-N
InChI=1S/C16H24O4/c1-11(2)8-13-4-6-14(7-5-13)12(3)16(19)20-10-15(18)9-17/h4-7,11-12,15,17-18H,8-10H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C16H24O4
Molecular Weight 280.3594
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:09:48 GMT 2025
Edited
by admin
on Wed Apr 02 17:09:48 GMT 2025
Record UNII
VR943M2ZLA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3-Dihydroxypropyl 2-(4-isobutylphenyl)propanoate
Preferred Name English
2,3-Dihydroxypropyl ?-methyl-4-(2-methylpropyl)benzeneacetate
Systematic Name English
Benzeneacetic acid, ?-methyl-4-(2-methylpropyl)-, 2,3-dihydroxypropyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
VR943M2ZLA
Created by admin on Wed Apr 02 17:09:48 GMT 2025 , Edited by admin on Wed Apr 02 17:09:48 GMT 2025
PRIMARY
CAS
64622-21-5
Created by admin on Wed Apr 02 17:09:48 GMT 2025 , Edited by admin on Wed Apr 02 17:09:48 GMT 2025
PRIMARY
PUBCHEM
13175019
Created by admin on Wed Apr 02 17:09:48 GMT 2025 , Edited by admin on Wed Apr 02 17:09:48 GMT 2025
PRIMARY