Acetyl isothiocyanate
SIGMA/01230 - ≥97.0% (GC)
CAS Number: 13250-46-9
Empirical Formula (Hill Notation): C3H3NOS
Molecular Weight: 101.13
MDL Number: MFCD01862831
Linear Formula: CH3CON=C=S
Product Type: Chemical
| assay | ≥97.0% (GC) |
| bp | 132-133 °C (lit.) |
| density | 1.151 g/mL at 20 °C (lit.) |
| form | liquid |
| InChI | 1S/C3H3NOS/c1-3(5)4-2-6/h |
| InChI key | VITFJKNVGRZRKB-UHFFFAOYSA |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | CC(=O)N=C=S |
| storage temp. | −20°C |
