2237-30-1
| Name | 3-Aminobenzonitrile |
| CAS | 2237-30-1 |
| EINECS(EC#) | 218-800-5 |
| Molecular Formula | C7H6N2 |
| MDL Number | MFCD00007756 |
| Molecular Weight | 118.14 |
| MOL File | 2237-30-1.mol |
Chemical Properties
| Appearance | BROWN CRYSTALLINE SOLID |
| Melting point | 48-53 °C(lit.) |
| Boiling point | 288-290 °C |
| density | 1.5511 (rough estimate) |
| refractive index | 1.5500 (estimate) |
| Fp | 112 °C |
| solubility | soluble in Methanol |
| form | Crystalline Solid |
| pka | 2.75(at 25℃) |
| color | Brown |
| Detection Methods | GC,NMR |
| BRN | 636498 |
| InChI | InChI=1S/C7H6N2/c8-5-6-2-1-3-7(9)4-6/h1-4H,9H2 |
| InChIKey | NJXPYZHXZZCTNI-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=CC(N)=C1 |
| CAS DataBase Reference | 2237-30-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzonitrile, 3-amino-(2237-30-1) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302+H312+H332-H317 |
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312 |
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 3276 |
| WGK Germany | 3 |
| RTECS | DI2454000 |
| Hazard Note | Harmful |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29214200 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Skin Sens. 1 |