3-Cyanophenyl isocyanate
- Product Name3-Cyanophenyl isocyanate
- CAS16413-26-6
- CBNumberCB5418752
- MFC8H4N2O
- MW144.13
- MDL NumberMFCD00013856
- MOL File16413-26-6.mol
Chemical Properties
| Melting point: | 51-54 °C(lit.) |
| Boiling point: | 262.72°C (rough estimate) |
| Density | 1.2851 (rough estimate) |
| refractive index | 1.4900 (estimate) |
| form | Low Melting Solid |
| color | Off-white to slightly yellow |
| Sensitive | Moisture Sensitive |
| BRN | 3089117 |
| InChI | 1S/C8H4N2O/c9-5-7-2-1-3-8(4-7)10-6-11/h1-4H |
| InChIKey | NZHPVPMRNASEQK-UHFFFAOYSA-N |
| SMILES | O=C=Nc1cccc(c1)C#N |
| CAS DataBase Reference | 16413-26-6(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
  GHS07,GHS08 |
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| Signal word | Danger | |||||||||
| Hazard statements | H302+H312+H332-H315-H317-H319-H334-H335 | |||||||||
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P305+P351+P338 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 20/21/22-36/37/38 | |||||||||
| Safety Statements | 7-26-27-37/39-36/37/39 | |||||||||
| RIDADR | 2206 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Irritant | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | II | |||||||||
| HS Code | 2929109000 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications |
Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |
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| Limited Quantities | 5.0 kg (11 lbs) (solid) | |||||||||
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) | |||||||||
| NFPA 704: |
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