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| IUPAC Name: | 1-isocyanatooctane |
| Description: | Octyl isocyanate (CAS# 3158-26-7) is a useful research chemical. |
| Molecular Weight: | 155.24 |
| Molecular Formula: | C9H17NO |
| Canonical SMILES: | CCCCCCCCN=C=O |
| InChI: | InChI=1S/C9H17NO/c1-2-3-4-5-6-7-8-10-9-11/h2-8H2,1H3 |
| InChI Key: | DYQFCTCUULUMTQ-UHFFFAOYSA-N |
| Boiling Point: | 200-204 °C |
| Purity: | 95 % |
| Density: | 0.88 g/cm3 |
| Appearance: | Turbid milky to light yellow liquid |
| Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| MDL: | MFCD00013887 |
| LogP: | 2.68270 |
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