Pentyl isocyanate
ALDRICH/389951 - 98%
CAS Number: 3954-13-0
Empirical Formula (Hill Notation): C6H11NO
Molecular Weight: 113.16
MDL Number: MFCD00144846
Linear Formula: CH3(CH2)4NCO
Product Type: Chemical
| assay | 98% |
| bp | 136-137 °C (lit.) |
| density | 0.878 g/mL at 25 °C (lit.) |
| form | liquid |
| functional group | amine |
| isocyanate | |
| InChI | 1S/C6H11NO/c1-2-3-4-5-7-6 |
| InChI key | VRVUKQWNRPNACD-UHFFFAOYSA |
| Quality Level | 100 ![]() |
| refractive index | n |
| SMILES string | CCCCCN=C=O |
| Packaging: | 1, 5 g in glass bottle |
| Symbol | ![]() ![]() ![]() GHS02,GHS05,GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H226 - H312 + H332 - H315 - H317 - H318 - H334 - H335 |
| Precautionary statements | P210 - P233 - P240 - P280 - P303 + P361 + P353 - P305 + P351 + P338 |
| Hazard Codes | Xn |
| Risk Statements | 10-20/21/22-36/37/38-41 |
| Safety Statements | 16-26-36/37/39-45 |
| RIDADR | UN 3080PSN1 3(6.1) / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 89.6 °F - closed cup |
| Flash Point(C) | 32 °C - closed cup |
| Purity | 98% |
| bp | 136-137 °C (lit.) |
| Density | 0.878 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |





