4-Aminophenylacetonitrile
- Product Name4-Aminophenylacetonitrile
- CAS3544-25-0
- CBNumberCB0778671
- MFC8H8N2
- MW132.16
- EINECS222-587-4
- MDL NumberMFCD00007912
- MOL File3544-25-0.mol
Chemical Properties
| Melting point: | 45-48 °C(lit.) |
| Boiling point: | 312 °C(lit.) |
| Density | 1.4747 (rough estimate) |
| refractive index | 1.6231 (estimate) |
| Flash point: | >230 °F |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | soluble in Methanol |
| pka | 4.25±0.10(Predicted) |
| form | Crystalline Powder, Crystals or Chunks |
| color | Yellow to brown |
| Water Solubility | SLIGHTLY SOLUBLE |
| BRN | 1100108 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| InChI | 1S/C8H8N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5,10H2 |
| InChIKey | YCWRFIYBUQBHJI-UHFFFAOYSA-N |
| SMILES | Nc1ccc(CC#N)cc1 |
| CAS DataBase Reference | 3544-25-0(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-Aminophenylacetic acid nitrile(3544-25-0) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302+H312+H332 | |||||||||
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312 | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 20/21/22 | |||||||||
| Safety Statements | 36-36/37 | |||||||||
| RIDADR | 3276 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Harmful | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 2926909090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral | |||||||||
| 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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