2-(Dimethylamino)-4-(methylsulfanyl)butanoic acid
2-(dimethylamino)-4-methylsulfanylbutanoic acid
Also Known As: Dimethylmethionine|Methionine Impurity 4|N,N,S-trimethylhomocysteine|2-(dimethylamino)-4-(methylsulfanyl)butanoic acid|methionine, n,n-dimethyl-, dl- (8ci)|NCI60_004055|2-(Dimethylamino)-4-(methylthio)butanoic Acid|2-(dimethylamino)-4-methylsulfanylbutanoic acid|895-759-5
CAS: 2812-23-9
| Molecular Formula | C7H15NO2S |
|---|---|
| Molecular Weight | 177.08235 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 177.08235 |
| Monoisotopic Mass | 177.08235 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 2812-23-9 |
|---|---|
| SMILES | CN(C)C(CCSC)C(=O)O |
| InChIKey | FLEXUHXAXRFRAU-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)-4-(methylsulfanyl)butanoic acid (CAS 2812-23-9), with molecular formula C7H15NO2S and molecular weight 177.08235 g/mol. IUPAC: 2-(dimethylamino)-4-methylsulfanylbutanoic 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.
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