2-Fluorophenyl isocyanate
ALDRICH/159352 - 97%
CAS Number: 16744-98-2
Empirical Formula (Hill Notation): C7H4FNO
Molecular Weight: 137.11
EC Number: 240-804-0
MDL Number: MFCD00001996
Linear Formula: FC6H4NCO
Product Type: Chemical
| assay | 97% |
| density | 1.222 g/mL at 25 °C (lit.) |
| form | liquid |
| functional group | fluoro |
| isocyanate | |
| InChI | 1S/C7H4FNO/c8-6-3-1-2-4-7 |
| InChI key | VZNCSZQPNIEEMN-UHFFFAOYSA |
| Quality Level | 100 ![]() |
| refractive index | n |
| SMILES string | Fc1ccccc1N=C=O |
| storage temp. | 2-8°C |
| General description: | 2-Fluorophenyl isocyanate is the main component of essential oil from Rhododendron thymifolium Maxim. Molecular geometry of 2-fluorophenyl isocyanate has been investigated by microwave spectroscopy and nuclear magnetic resonance spectroscopy. |
| Packaging: | 5, 25 g in glass bottle |
| Symbol | ![]() ![]() GHS02,GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H226 - H302 + H312 + H332 - H315 - H317 - H319 - H334 - H335 |
| Precautionary statements | P210 - P233 - P280 - P301 + P312 - P303 + P361 + P353 - P305 + P351 + P338 |
| Hazard Codes | Xn |
| Risk Statements | 10-20/21/22-36/37/38 |
| Safety Statements | 16-23-26-27-28-36/37/39 |
| RIDADR | UN 3080PSN1 3(6.1) / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 123.8 °F - closed cup |
| Flash Point(C) | 51 °C - closed cup |
| Purity | 97% |
| Density | 1.222 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 12352100 |




