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Details

Stereochemistry RACEMIC
Molecular Formula C18H16O5
Molecular Weight 312.3166
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOIN HEMISUCCINATE

SMILES

OC(=O)CCC(=O)OC(C(=O)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=JIXPXNUZJCCKGO-UHFFFAOYSA-N
InChI=1S/C18H16O5/c19-15(20)11-12-16(21)23-18(14-9-5-2-6-10-14)17(22)13-7-3-1-4-8-13/h1-10,18H,11-12H2,(H,19,20)

HIDE SMILES / InChI

Molecular Formula C18H16O5
Molecular Weight 312.3166
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 Jul 07 00:04:32 UTC 2023
Edited
by admin
on Fri Jul 07 00:04:32 UTC 2023
Record UNII
G9TTH827BK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIN HEMISUCCINATE
Common Name English
4-OXO-4-(2-OXO-1,2-DIPHENYLETHOXY)BUTANOIC ACID
Systematic Name English
BENZOIN SUCCINATE
Common Name English
1-(2-OXO-1,2-DIPHENYLETHYL) BUTANEDIOATE
Systematic Name English
BUTANEDIOIC ACID, 1-(2-OXO-1,2-DIPHENYLETHYL) ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
2735456
Created by admin on Fri Jul 07 00:04:33 UTC 2023 , Edited by admin on Fri Jul 07 00:04:33 UTC 2023
PRIMARY
FDA UNII
G9TTH827BK
Created by admin on Fri Jul 07 00:04:33 UTC 2023 , Edited by admin on Fri Jul 07 00:04:33 UTC 2023
PRIMARY
CAS
24248-42-8
Created by admin on Fri Jul 07 00:04:33 UTC 2023 , Edited by admin on Fri Jul 07 00:04:33 UTC 2023
PRIMARY
EPA CompTox
DTXSID80605193
Created by admin on Fri Jul 07 00:04:33 UTC 2023 , Edited by admin on Fri Jul 07 00:04:33 UTC 2023
PRIMARY
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