(5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid
(5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid
Also Known As: Cystathionine ketimine|(5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid|-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylicacid|1,4-Thiazepine-3,5-dicarboxylic acid, 2,5,6,7-tetrahydro-, (R)-|1,4-Thiazepine-3,5-dicarboxylicacid, 2,5,6,7-tetrahydro-, (5R)-|1,4-Thiazepine-3,5-dicarboxylic acid, 2,5,6,7-tetrahydro-, (5R)-
CAS: 87254-95-3
| Molecular Formula | C7H9NO4S |
|---|---|
| Molecular Weight | 203.02522 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.02522 |
| Monoisotopic Mass | 203.02522 |
| Heavy Atoms | 13 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 87254-95-3 |
|---|---|
| SMILES | C1CSCC(=N[C@H]1C(=O)O)C(=O)O |
| InChIKey | XJUQJVUYGRTQGI-SCSAIBSYSA-N |
Product Overview
(5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid (CAS 87254-95-3), with molecular formula C7H9NO4S and molecular weight 203.02522 g/mol. IUPAC: (5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic 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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