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| IUPAC Name: | benzoyl isothiocyanate |
| Description: | Benzoyl isothiocyanate (CAS# 532-55-8) is a compound useful in organic synthesis. |
| Molecular Weight: | 163.20 |
| Molecular Formula: | C8H5NOS |
| Canonical SMILES: | C1=CC=C(C=C1)C(=O)N=C=S |
| InChI: | InChI=1S/C8H5NOS/c10-8(9-6-11)7-4-2-1-3-5-7/h1-5H |
| InChI Key: | CPEKAXYCDKETEN-UHFFFAOYSA-N |
| Boiling Point: | 128-131 °C (15 mmHg) |
| Melting Point: | 128 °C |
| Purity: | 95 % |
| Density: | 1.214 g/cm3 |
| Appearance: | Pale yellow oil |
| Storage: | Keep Cold |
| MDL: | MFCD00004815 |
| LogP: | 1.92960 |
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