bis[3-(trifluoromethyl)phenyl]methanol

C15H10F6O — CID 2736113

IUPACbis[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H10F6O/c16-14(17,18)11-5-1-3-9(7-11)13(22)10-4-2-6-12(8-10)15(19,20)21/h1-8,13,22H
InChIKeyWWKAKFGJTVATRV-UHFFFAOYSA-N
MW320.23 g/mol
LogP4.81
Rot. Bonds2

About bis[3-(trifluoromethyl)phenyl]methanol

bis[3-(trifluoromethyl)phenyl]methanol (PubChem CID 2736113) has the molecular formula C15H10F6O and a molecular weight of 320.23 g/mol. Its IUPAC name is bis[3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Namebis[3-(trifluoromethyl)phenyl]methanol
PubChem CID2736113
Molecular FormulaC15H10F6O
Molecular Weight320.23 g/mol
Exact Mass320.06
IUPAC Namebis[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H10F6O/c16-14(17,18)11-5-1-3-9(7-11)13(22)10-4-2-6-12(8-10)15(19,20)21/h1-8,13,22H
InChIKeyWWKAKFGJTVATRV-UHFFFAOYSA-N
XLogP4.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bis[3-(trifluoromethyl)phenyl]methanol?
The IUPAC name of bis[3-(trifluoromethyl)phenyl]methanol (CID 2736113) is bis[3-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for bis[3-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for bis[3-(trifluoromethyl)phenyl]methanol is OC(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1.
What is the InChIKey of bis[3-(trifluoromethyl)phenyl]methanol?
The InChIKey is WWKAKFGJTVATRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F6O/c16-14(17,18)11-5-1-3-9(7-11)13(22)10-4-2-6-12(8-10)15(19,20)21/h1-8,13,22H.
What are the key properties of bis[3-(trifluoromethyl)phenyl]methanol?
bis[3-(trifluoromethyl)phenyl]methanol has a molecular weight of 320.23 g/mol, XLogP of 4.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis[3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 2736113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).