3,5-Diaminobenzotrifluoride
- Product Name3,5-Diaminobenzotrifluoride
- CAS368-53-6
- CBNumberCB1247248
- MFC7H7F3N2
- MW176.14
- EINECS206-708-8
- MDL NumberMFCD00014776
- MOL File368-53-6.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 87-89 °C(lit.) |
| Boiling point | 275.0±40.0 °C(Predicted) |
| Density | 1.2773 (estimate) |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| pka | 3.66±0.10(Predicted) |
| form | Solid |
| color | Brown |
| BRN | 2966748 |
| InChI | InChI=1S/C7H7F3N2/c8-7(9,10)4-1-5(11)3-6(12)2-4/h1-3H,11-12H2 |
| InChIKey | KZSXRDLXTFEHJM-UHFFFAOYSA-N |
| SMILES | C1(N)=CC(C(F)(F)F)=CC(N)=C1 |
| CAS DataBase Reference | 368-53-6(CAS DataBase Reference) |
| FDA UNII | Z89RD529KK |
| EPA Substance Registry System | 1,3-Benzeneamine, 5-[(trifluoromethyl)- (368-53-6) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
 
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| Signal word | Danger | |||||||||
| Hazard statements | H302-H318 | |||||||||
| Precautionary statements | P280-P305+P351+P338 | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 22-41 | |||||||||
| Safety Statements | 26-39 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | CZ1606000 | |||||||||
| Hazard Note | Irritant | |||||||||
| HazardClass | IRRITANT, IRRITANT-HARMFUL | |||||||||
| HazardClass | 6.1 | |||||||||
| HS Code | 2921511990 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 | |||||||||
| NFPA 704: |
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