Acetic acid, [[(benzoylamino)acetyl]thio]- structure

Acetic acid, [[(benzoylamino)acetyl]thio]-

2-(2-benzamidoacetyl)sulfanylacetic acid

Also Known As: hippuroylmercapto-acetic acid|2-(2-benzamidoacetyl)sulfanylacetic Acid|Acetic acid, [[(benzoylamino)acetyl]thio]-|[(N-Benzoylglycyl)sulfanyl]acetic acid|2-[2-(Benzoylamino)acetylthio]acetic acid|2-{[2-(phenylformamido)acetyl]sulfanyl}acetic acid

CAS: 2979-64-8
Molecular Formula C11H11NO4S
Molecular Weight 253.04088 g/mol
LogP 0.7608
Topological Polar Surface Area 83.47 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 253.04088
Monoisotopic Mass 253.04088
Heavy Atoms 17
Complexity 418.7394

Chemical Identifiers

CAS Number 2979-64-8
SMILES C1=CC=C(C=C1)C(=O)NCC(=O)SCC(=O)O

Product Overview

Acetic acid, [[(benzoylamino)acetyl]thio]- (CAS 2979-64-8), with molecular formula C11H11NO4S and molecular weight 253.04088 g/mol. IUPAC: 2-(2-benzamidoacetyl)sulfanylacetic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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