N-Acetyl-3-mercapto-DL-valine

2-acetamido-3-methyl-3-sulfanylbutanoic acid

CAS: 59-53-0

Molecular Formula	`C7H13NO3S`
Molecular Weight	191.25 g/mol
LogP	0.1
Topological Polar Surface Area	67.4 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	191.06161
Heavy Atoms	12
Complexity	203.0

Chemical Identifiers

CAS Number	59-53-0
SMILES	`CC(=O)NC(C(=O)O)C(C)(C)S`
InChIKey	`MNNBCKASUFBXCO-UHFFFAOYSA-N`

📖 Product Overview

N-Acetyl-3-mercapto-DL-valine (CAS: 59-53-0) is a chemical compound with molecular formula C7H13NO3S and molecular weight 191.25 g/mol. Its IUPAC systematic name is 2-acetamido-3-methyl-3-sulfanylbutanoic acid. LogP 0.1 Topological Polar Surface Area 67.4 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 3 Exact Mass 191.06161 Heavy Atoms 12 Complexity 203.0 InChI Key: MNNBCKASUFBXCO-UHFFFAOYSA-N. SMILES: CC(=O)NC(C(=O)O)C(C)(C)S.

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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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