3-Hydroxy-1-benzothiophene-2-carbonitrile
3-hydroxy-1-benzothiophene-2-carbonitrile
Also Known As: 3-hydroxy-1-benzothiophene-2-carbonitrile|3-Hydroxybenzo[b]thiophene-2-carbonitrile|Oprea1_082009|3-hydroxybenzothiophene-2-carbonitrile|KS-00001WD8|2-Cyano-3-hydroxybenzo<4.5>thiophen|3-hydroxy-benzo[b]thiophene-2-carbonitrile|Benzo[b]thiophene-2-carbonitrile, 3-hydroxy-|4F-953|AB-337/05459043
| Molecular Formula | C9H5NOS |
|---|---|
| Molecular Weight | 175.00919 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.00919 |
| Monoisotopic Mass | 175.00919 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 57477-69-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C#N)O |
| InChIKey | DOXMOBZBFOKSIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Hydroxy-1-benzothiophene-2-carbonitrile (CAS 57477-69-7), with molecular formula C9H5NOS and molecular weight 175.00919 g/mol. IUPAC: 3-hydroxy-1-benzothiophene-2-carbonitrile.
3-Hydroxy-1-benzothiophene-2-carbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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