S,S-Efinaconazole
- Product NameS,S-Efinaconazole
- CAS164650-45-7
- MFC18H22F2N4O
- MW348.39
- EINECS
- MOL File164650-45-7.mol
Chemical Properties
| Boiling point | 512.2±60.0 °C(Predicted) |
| Density | 1.26±0.1 g/cm3(Predicted) |
| pka | 12.11±0.29(Predicted) |
| InChI | InChI=1/C18H22F2N4O/c1-13-5-7-23(8-6-13)14(2)18(25,10-24-12-21-11-22-24)16-4-3-15(19)9-17(16)20/h3-4,9,11-12,14,25H,1,5-8,10H2,2H3/t14-,18-/s3 |
| InChIKey | NFEZZTICAUWDHU-GKGMEZMPNA-N |
| SMILES | N1([C@@H](C)[C@](C2=CC=C(F)C=C2F)(CN2C=NC=N2)O)CCC(=C)CC1 |&1:1,3,r| |