4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol | SBID = 2150 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 40.5 | ||
| Ertl TPSA/Å2: | 40.46 | ||
| Hydrophilicity (PubChem XLogP): | 4.5 | ||
| Hydrophilicity (Cheng XLogP3): | 4.47 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| Number of H-Bond Acceptors: | 8.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 224.5 | ||
| Sum Formula: | C15H10F6O2 | ||
| M / g/mol: | 336.23 | ||
| Complexity: | 352.0 | ||
| Number of Conformers: | 2.0 |
Identifiers
- Tags:
- Name: 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol
- Preferred Abbreviation: Bisphenol AF
- IUPAC Name: 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol
- CAS:
- CID: 73864
- InChiKey: ZFVMWEVVKGLCIJ-UHFFFAOYSA-N
- InChi: InChI=1S/C15H10F6O2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8,22-23H
- CanoSmiles: C1=CC(=CC=C1C(C2=CC=C(C=C2)O)(C(F)(F)F)C(F)(F)F)O
- IsoSmiles: C1=CC(=CC=C1C(C2=CC=C(C=C2)O)(C(F)(F)F)C(F)(F)F)O
