4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol

C20H12ClF3O — CID 70902688

IUPAC4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(-c3ccccc3)cc21
InChIInChI=1S/C20H12ClF3O/c21-17-11-13(12-6-2-1-3-7-12)10-16-18(17)14-8-4-5-9-15(14)19(16,25)20(22,23)24/h1-11,25H
InChIKeySOKWTDDLIHQEAB-UHFFFAOYSA-N
MW360.76 g/mol
LogP5.79
Rot. Bonds1

About 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol

4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 70902688) has the molecular formula C20H12ClF3O and a molecular weight of 360.76 g/mol. Its IUPAC name is 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol
PubChem CID70902688
Molecular FormulaC20H12ClF3O
Molecular Weight360.76 g/mol
Exact Mass360.05
IUPAC Name4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(-c3ccccc3)cc21
InChIInChI=1S/C20H12ClF3O/c21-17-11-13(12-6-2-1-3-7-12)10-16-18(17)14-8-4-5-9-15(14)19(16,25)20(22,23)24/h1-11,25H
InChIKeySOKWTDDLIHQEAB-UHFFFAOYSA-N
XLogP5.79
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.76
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

bis(4-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-2-carboxylic acid);(1S)-1-phenylethanamine
CID 158464520
2-(4-fluorophenyl)-9-(trifluoromethyl)fluoren-9-ol
CID 59492604
2-[2-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-4-yl]acetonitrile
CID 59493071
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]benzoic acid
CID 59493131
4-bromo-9-(trifluoromethyl)fluoren-9-ol
CID 59493116
2-(4-chloro-9,9-dimethylfluoren-2-yl)-4,6-diphenyl-1,3,5-triazine
CID 175634418
2-(1-ethylpyrazol-4-yl)-4-(hydroxymethyl)-9-(trifluoromethyl)fluoren-9-ol
CID 59492745
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]benzamide
CID 59492649
4-prop-1-en-2-yl-9-(trifluoromethyl)fluoren-9-ol
CID 59492630
2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol
CID 67228250
1-[4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]phenyl]propan-1-one
CID 149259882
2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]-2-methylpropanoic acid
CID 59492526

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol (CID 70902688) is 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol is OC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(-c3ccccc3)cc21.
What is the InChIKey of 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is SOKWTDDLIHQEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12ClF3O/c21-17-11-13(12-6-2-1-3-7-12)10-16-18(17)14-8-4-5-9-15(14)19(16,25)20(22,23)24/h1-11,25H.
What are the key properties of 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol?
4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 360.76 g/mol, XLogP of 5.79, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 70902688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).