Hexyl isocyanate
ALDRICH/414883 - 97%
CAS Number: 2525-62-4
Empirical Formula (Hill Notation): C7H13NO
Molecular Weight: 127.18
EC Number: 219-763-8
MDL Number: MFCD00037047
Linear Formula: CH3(CH2)5NCO
Product Type: Chemical
| assay | 97% |
| bp | 162-164 °C (lit.) |
| density | 0.873 g/mL at 25 °C (lit.) |
| form | liquid |
| functional group | amine |
| isocyanate | |
| InChI | 1S/C7H13NO/c1-2-3-4-5-6-8 |
| InChI key | ANJPRQPHZGHVQB-UHFFFAOYSA |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | CCCCCCN=C=O |
| Application: | Hexyl isocyanate may be employed for the synthesis of following: • rigid-rod, helical isocyanate-based macromonomers • rod-coil-rod triblock copolymers with 2-vinylpyridine, by living anionic polymerization • chiral poly(n-hexyl isocyanate) (PHIC) macromonomers, by living anionic polymerization |
| General description: | Hexyl isocyanate has been investigated for its antigenicity in the guinea pig animal model of hapten-specific respiratory hypersensitivity. Polymerization of n-hexyl isocyanate using rare earth tris(2,6-di-tert-butyl-4-methylphenolate) [Ln(OAr)3] as initiator has been studied. |
| Packaging: | 5, 25 mL in glass bottle |
| Symbol |    GHS02,GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H226 - H302 + H312 + H332 - H317 - H334 |
| Precautionary statements | P210 - P233 - P280 - P301 + P312 - P303 + P361 + P353 - P304 + P340 + P312 |
| Hazard Codes | Xn |
| Risk Statements | 10-20/21/22-42 |
| Safety Statements | 23-36/37 |
| RIDADR | UN 3080PSN1 3(6.1) / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 138.2 °F - closed cup |
| Flash Point(C) | 59 °C - closed cup |
| Purity | 97% |
| bp | 162-164 °C (lit.) |
| Density | 0.873 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |