4-(4-Fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic acid
4-(4-fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic acid
Also Known As: 4-(4-fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic acid|4-(4-fluorophenyl)-2H,3H-benzo[b]1,4-thiazepine-2-carboxylic acid|5-(4-fluorophenyl)-2-thia-6-azabicyclo[5.4.0]undeca-5,7,9,11-tetraene-3-carboxylic Acid
CAS: 853902-04-2
| Molecular Formula | C16H12FNO2S |
|---|---|
| Molecular Weight | 301.05728 g/mol |
| LogP | 3.8955 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.05728 |
| Monoisotopic Mass | 301.05728 |
| Heavy Atoms | 21 |
| Complexity | 712.47186 |
Chemical Identifiers
| CAS Number | 853902-04-2 |
|---|---|
| SMILES | C1C(SC2=CC=CC=C2N=C1C3=CC=C(C=C3)F)C(=O)O |
Product Overview
4-(4-Fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic acid (CAS 853902-04-2), with molecular formula C16H12FNO2S and molecular weight 301.05728 g/mol. IUPAC: 4-(4-fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic 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 →
4-(4-Fluorophenyl)-2,3-dihydro-1,5-benzothiazepine-2-carboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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