![4-[Hydroxy(phenyl)methyl]-3,4-dihydro-1-benzothiepin-5(2H)-one structure](/static/products/4032/40322-45-0.webp)
4-[Hydroxy(phenyl)methyl]-3,4-dihydro-1-benzothiepin-5(2H)-one
4-[hydroxy(phenyl)methyl]-3,4-dihydro-2H-1-benzothiepin-5-one
Also Known As: 4-[Hydroxy(phenyl)methyl]-3,4-dihydro-1-benzothiepin-5(2H)-one|4-[hydroxy(phenyl)methyl]-3,4-dihydro-2H-1-benzothiepin-5-on|4-(Hydroxy-phenyl-methyl)-3,4-dihydro-2H-benzo[b]thiepin-5-one|4-[hydroxy(phenyl)methyl]-3,4-dihydro-2H-1-benzothiepin-5-one
CAS: 40322-45-0
| Molecular Formula | C17H16O2S |
|---|---|
| Molecular Weight | 284.0871 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.0871 |
| Monoisotopic Mass | 284.0871 |
| Heavy Atoms | 20 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 40322-45-0 |
|---|---|
| SMILES | C1CSC2=CC=CC=C2C(=O)C1C(C3=CC=CC=C3)O |
| InChIKey | AJAVRBXBQDKTOL-UHFFFAOYSA-N |
Product Overview
4-[Hydroxy(phenyl)methyl]-3,4-dihydro-1-benzothiepin-5(2H)-one (CAS 40322-45-0), with molecular formula C17H16O2S and molecular weight 284.0871 g/mol. IUPAC: 4-[hydroxy(phenyl)methyl]-3,4-dihydro-2H-1-benzothiepin-5-one.
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-[Hydroxy(phenyl)methyl]-3,4-dihydro-1-benzothiepin-5(2H)-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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