U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H14O3
Molecular Weight 254.2806
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOIN ACETATE, (R)-

SMILES

CC(=O)O[C@@H](C(=O)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=QRWAIZJYJNLOPG-MRXNPFEDSA-N
InChI=1S/C16H14O3/c1-12(17)19-16(14-10-6-3-7-11-14)15(18)13-8-4-2-5-9-13/h2-11,16H,1H3/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H14O3
Molecular Weight 254.2806
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:10:37 GMT 2023
Edited
by admin
on Sat Dec 16 19:10:37 GMT 2023
Record UNII
255PF3R52H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIN ACETATE, (R)-
Systematic Name English
(R)-BENZOIN ACETATE
Systematic Name English
((1R)-2-OXO-1,2-DIPHENYLETHYL) ACETATE
Systematic Name English
(2R)-2-(ACETYLOXY)-1,2-DIPHENYLETHANONE
Systematic Name English
ETHANONE, 2-(ACETYLOXY)-1,2-DIPHENYL-, (2R)-
Systematic Name English
BENZOIN ACETATE, (-)-
Systematic Name English
(R)-1,2-DIPHENYL-2-OXOETHYL ACETATE
Systematic Name English
2'-AMINOACETANILIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
683973
Created by admin on Sat Dec 16 19:10:37 GMT 2023 , Edited by admin on Sat Dec 16 19:10:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID60350598
Created by admin on Sat Dec 16 19:10:37 GMT 2023 , Edited by admin on Sat Dec 16 19:10:37 GMT 2023
PRIMARY
FDA UNII
255PF3R52H
Created by admin on Sat Dec 16 19:10:37 GMT 2023 , Edited by admin on Sat Dec 16 19:10:37 GMT 2023
PRIMARY
CAS
84275-45-6
Created by admin on Sat Dec 16 19:10:37 GMT 2023 , Edited by admin on Sat Dec 16 19:10:37 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER