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36092-42-9

36092-42-9 Structure

36092-42-9 Structure
IdentificationMore
[Name]

DL-BENZYLSUCCINIC ACID
[CAS]

36092-42-9
[Synonyms]

2-BENZYLSUCCINIC ACID
AKOS BC-1260
ALPHA-BENZYLSUCCINIC ACID
BENZYL BUTANEDIOIC ACID
DL-BENZYLSUCCINIC ACID
Benzylsuccinic acid
[Molecular Formula]

C11H12O4
[MDL Number]

MFCD00055798
[Molecular Weight]

208.21
[MOL File]

36092-42-9.mol
Chemical PropertiesBack Directory
[Appearance]

Off-White Solid
[Melting point ]

160-161°C
[storage temp. ]

-20°C Freezer
[pka]

pK1: 4.11;pK2: 5.65 (20°C)
[Usage]

An effective inhibitor of carboxypeptidase A
[InChI]

InChI=1S/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)
[InChIKey]

GTOFKXZQQDSVFH-UHFFFAOYSA-N
[SMILES]

C(C(=O)O)(CC(=O)O)CC1C=CC=CC=1
[CAS DataBase Reference]

36092-42-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[WGK Germany ]

3
Hazard InformationBack Directory
[Chemical Properties]

Off-White Solid
[Uses]

An effective inhibitor of carboxypeptidase A
[Definition]

ChEBI: 2-benzylsuccinic acid is a dicarboxylic acid consisting of succinic acid carrying a 2-benzyl substituent. It has a role as a bacterial xenobiotic metabolite. It is functionally related to a succinic acid. It is a conjugate acid of a 2-benzylsuccinate(2-) and a (R)-2-benzylsuccinate.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

36092-42-9(sigmaaldrich)
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