Doravirine
- Product NameDoravirine
- CAS1338225-97-0
- CBNumberCB92516043
- MFC17H11ClF3N5O3
- MW425.75
- MDL NumberMFCD22417167
- MOL File1338225-97-0.mol
- MSDS FileSDS
Chemical Properties
| Melting point | >278°C (dec.) |
| Density | 1.56±0.1 g/cm3(Predicted) |
| storage temp. | -20°C Freezer |
| solubility | DMSO (Slightly, Heated), Methanol (Slightly, Heated) |
| form | Solid |
| pka | 8.04±0.20(Predicted) |
| color | White to Off-White |
| InChI | InChI=1S/C17H11ClF3N5O3/c1-25-13(23-24-16(25)28)8-26-3-2-12(17(19,20)21)14(15(26)27)29-11-5-9(7-22)4-10(18)6-11/h2-6H,8H2,1H3,(H,24,28) |
| InChIKey | ZIAOVIPSKUPPQW-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC(OC2=C(C(F)(F)F)C=CN(CC3N(C)C(=O)NN=3)C2=O)=CC(Cl)=C1 |
| FDA UNII | 913P6LK81M |
| ATC code | J05AG06 |
| Comptox DTXSID | DTXSID30158386 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319 | |||||||||
| Precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 | |||||||||
| NFPA 704: |
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