3-Hydroxymethyl-3H-benzooxazole-2-thione
3-(hydroxymethyl)-1,3-benzoxazole-2-thione
Also Known As: 3-(Hydroxymethyl)-2-benzoxazolinethione|3-(hydroxymethyl)-1,3-benzoxazole-2-thione|3-(hydroxymethyl)benzo[d]oxazole-2(3H)-thione|3-HYDROXYMETHYL-3H-BENZOOXAZOLE-2-THIONE|3-(hydroxymethyl)-1,3-benzoxazole-2(3H)-thione
CAS: 3161-58-8
| Molecular Formula | C8H7NO2S |
|---|---|
| Molecular Weight | 181.01974 g/mol |
| LogP | 1.91359 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.01974 |
| Monoisotopic Mass | 181.01974 |
| Heavy Atoms | 12 |
| Complexity | 457.27097 |
Chemical Identifiers
| CAS Number | 3161-58-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=S)O2)CO |
Product Overview
3-Hydroxymethyl-3H-benzooxazole-2-thione (CAS 3161-58-8), with molecular formula C8H7NO2S and molecular weight 181.01974 g/mol. IUPAC: 3-(hydroxymethyl)-1,3-benzoxazole-2-thione.
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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