2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol

C20H12ClF3O — CID 59493191

IUPAC2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2ccc(-c3cccc(Cl)c3)cc21
InChIInChI=1S/C20H12ClF3O/c21-14-5-3-4-12(10-14)13-8-9-16-15-6-1-2-7-17(15)19(25,18(16)11-13)20(22,23)24/h1-11,25H
InChIKeyDUXONSDHJUHRBN-UHFFFAOYSA-N
MW360.76 g/mol
LogP5.79
Rot. Bonds1

About 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol

2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59493191) has the molecular formula C20H12ClF3O and a molecular weight of 360.76 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59493191
Molecular FormulaC20H12ClF3O
Molecular Weight360.76 g/mol
Exact Mass360.05
IUPAC Name2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2ccc(-c3cccc(Cl)c3)cc21
InChIInChI=1S/C20H12ClF3O/c21-14-5-3-4-12(10-14)13-8-9-16-15-6-1-2-7-17(15)19(25,18(16)11-13)20(22,23)24/h1-11,25H
InChIKeyDUXONSDHJUHRBN-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

(+)-4-chloro-2-methyl-9-trifluoromethyl-9H-fluoren-9-ol
CID 59492563
2-(4-Fluorophenyl)-9-(trifluoromethyl)fluoren-9-ol
CID 59492604
(+)-4-chloro-2-fluoro-9-trifluoromethyl-9H-fluoren-9-ol
CID 59492689
4-[4-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]benzoic acid
CID 59492772
2,4-Dichloro-9-(trifluoromethyl)fluoren-9-ol
CID 59492855
2-[4-(Hydroxymethyl)phenyl]-9-(trifluoromethyl)fluoren-9-ol
CID 59492892
2-(3-Fluorophenyl)-9-(trifluoromethyl)fluoren-9-ol
CID 59492986
2,4-Dimethyl-9-(trifluoromethyl)fluoren-9-ol
CID 59493040
2-Phenyl-9-(trifluoromethyl)fluoren-9-ol
CID 59493041
2-Chloro-4-(hydroxymethyl)-9-(trifluoromethyl)fluoren-9-ol
CID 59493070
4-Chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol
CID 70902688
2-[2-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-4-yl]acetonitrile
CID 59493071

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol (CID 59493191) is 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol is OC1(C(F)(F)F)c2ccccc2-c2ccc(-c3cccc(Cl)c3)cc21.
What is the InChIKey of 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is DUXONSDHJUHRBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12ClF3O/c21-14-5-3-4-12(10-14)13-8-9-16-15-6-1-2-7-17(15)19(25,18(16)11-13)20(22,23)24/h1-11,25H.
What are the key properties of 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol?
2-(3-chlorophenyl)-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 2-(3-chlorophenyl)-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59493191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).