but-2-enedioic acid;1-(4-chlorophenyl)sulfanyl-N-methylpropan-2-amine
but-2-enedioic acid;1-(4-chlorophenyl)sulfanyl-N-methylpropan-2-amine
Also Known As: but-2-enedioic acid; 1-(4-chlorophenyl)sulfanyl-N-methyl-propan-2-amine
CAS: 83197-87-9
| Molecular Formula | C14H18ClNO4S |
|---|---|
| Molecular Weight | 331.0645 g/mol |
| LogP | 2.7518 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.0645 |
| Monoisotopic Mass | 331.0645 |
| Heavy Atoms | 21 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 83197-87-9 |
|---|---|
| SMILES | CC(CSC1=CC=C(C=C1)Cl)NC.C(=CC(=O)O)C(=O)O |
| InChIKey | PGHOYMKBEPCNOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (3 patents)
Pharmaceutical Intermediates (2 patents)
Product Overview
but-2-enedioic acid;1-(4-chlorophenyl)sulfanyl-N-methylpropan-2-amine (CAS 83197-87-9), with molecular formula C14H18ClNO4S and molecular weight 331.0645 g/mol. IUPAC: but-2-enedioic acid;1-(4-chlorophenyl)sulfanyl-N-methylpropan-2-amine.
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 →
but-2-enedioic acid;1-(4-chlorophenyl)sulfanyl-N-methylpropan-2-amine is a custom synthesis product. We offer services from milligram to kilogram scale.
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