4-tert-Butylbenzonitrile
- Product Name4-tert-Butylbenzonitrile
- CAS4210-32-6
- CBNumberCB5208423
- MFC11H13N
- MW159.23
- EINECS224-137-2
- MDL NumberMFCD00075840
- MOL File4210-32-6.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 12-14 °C |
| Boiling point | 258 °C(lit.) |
| Density | 0.94 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | clear liquid |
| color | Colorless to Light yellow |
| Specific Gravity | 0.95 |
| BRN | 2080049 |
| InChI | InChI=1S/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3 |
| InChIKey | IIZURLNRIMKEDL-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(C(C)(C)C)C=C1 |
| LogP | 3.49 |
| CAS DataBase Reference | 4210-32-6(CAS DataBase Reference) |
| FDA UNII | Y968PR6AS9 |
| NIST Chemistry Reference | 4-t-Butylbenzonitrile(4210-32-6) |
| UNSPSC Code | 12352100 |
Safety
| Symbol(GHS) |
 
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H301+H311+H331-H312-H319-H332 | |||||||||
| Precautionary statements | P280-P305+P351+P338-P280h-P301+P312a-P304+P340-P321-P501a-P261-P264-P270-P271-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P403+P233-P405-P501 | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 20/21/22 | |||||||||
| Safety Statements | 36-36/37 | |||||||||
| RIDADR | 3276 | |||||||||
| WGK Germany | 2 | |||||||||
| Hazard Note | Irritant | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29269090 | |||||||||
| Storage Class | 10 - Combustible liquids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral | |||||||||
| NFPA 704: |
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