2-Acetamido-3-methyl-3-sulfanylpentanoic acid
2-acetamido-3-methyl-3-sulfanylpentanoic acid
Also Known As: Isoleucine,N-acetyl-3-mercapto-|DL-N-acetyl-beta-mercaptoisoleucine|2-acetamido-3-methyl-3-sulfanylpentanoic acid|2-(acetylamino)-3-methyl-3-sulfanylpentanoic acid(non-preferred name)|2-(acetylamino)-2,4,5-trideoxy-3-C-methyl-3-thiopentonic acid
CAS: 82162-83-2
| Molecular Formula | C8H15NO3S |
|---|---|
| Molecular Weight | 205.07727 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.07727 |
| Monoisotopic Mass | 205.07727 |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 82162-83-2 |
|---|---|
| SMILES | CCC(C)(C(C(=O)O)NC(=O)C)S |
| InChIKey | CQDYZFQNPRLEAK-UHFFFAOYSA-N |
Product Overview
2-Acetamido-3-methyl-3-sulfanylpentanoic acid (CAS 82162-83-2), with molecular formula C8H15NO3S and molecular weight 205.07727 g/mol. IUPAC: 2-acetamido-3-methyl-3-sulfanylpentanoic acid.
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.
View MSDS →
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