2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol

C20H13F3O2 — CID 59493031

IUPAC2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESOc1ccc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)cc1
InChIInChI=1S/C20H13F3O2/c21-20(22,23)19(25)17-4-2-1-3-15(17)16-10-7-13(11-18(16)19)12-5-8-14(24)9-6-12/h1-11,24-25H
InChIKeyFDZDIJRWYDIWHF-UHFFFAOYSA-N
MW342.32 g/mol
LogP4.84
Rot. Bonds1

About 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol

2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59493031) has the molecular formula C20H13F3O2 and a molecular weight of 342.32 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59493031
Molecular FormulaC20H13F3O2
Molecular Weight342.32 g/mol
Exact Mass342.09
IUPAC Name2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESOc1ccc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)cc1
InChIInChI=1S/C20H13F3O2/c21-20(22,23)19(25)17-4-2-1-3-15(17)16-10-7-13(11-18(16)19)12-5-8-14(24)9-6-12/h1-11,24-25H
InChIKeyFDZDIJRWYDIWHF-UHFFFAOYSA-N
XLogP4.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.32
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol (CID 59493031) is 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol is Oc1ccc(-c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is FDZDIJRWYDIWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F3O2/c21-20(22,23)19(25)17-4-2-1-3-15(17)16-10-7-13(11-18(16)19)12-5-8-14(24)9-6-12/h1-11,24-25H.
What are the key properties of 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol?
2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 342.32 g/mol, XLogP of 4.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59493031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).