WIY
Summary
Name: | 4,4,4-trifluorobutan-1-ol |
Formula: | C4 H7 F3 O |
Formal charge: | 0 |
Formula weight: | 128.093 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4,4,4-trifluorobutan-1-ol |
OpenEye OEToolkits | 2.0.7 | 4,4,4-tris(fluoranyl)butan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | FC(F)(F)CCCO |
InChI | InChI | 1.06 | InChI=1S/C4H7F3O/c5-4(6,7)2-1-3-8/h8H,1-3H2 |
InChIKey | InChI | 1.06 | VKRFUGHXKNNIJO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OCCCC(F)(F)F |
SMILES | CACTVS | 3.385 | OCCCC(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(CC(F)(F)F)CO |
SMILES | OpenEye OEToolkits | 2.0.7 | C(CC(F)(F)F)CO |