[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol

C14H10F4O — CID 171382914

IUPAC[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol
SMILESOCc1ccc(-c2cccc(C(F)(F)F)c2F)cc1
InChIInChI=1S/C14H10F4O/c15-13-11(2-1-3-12(13)14(16,17)18)10-6-4-9(8-19)5-7-10/h1-7,19H,8H2
InChIKeyFQKDFYPCUTUVJG-UHFFFAOYSA-N
MW270.23 g/mol
LogP4.00
Rot. Bonds2

About [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol

[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol (PubChem CID 171382914) has the molecular formula C14H10F4O and a molecular weight of 270.23 g/mol. Its IUPAC name is [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol
PubChem CID171382914
Molecular FormulaC14H10F4O
Molecular Weight270.23 g/mol
Exact Mass270.07
IUPAC Name[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol
SMILESOCc1ccc(-c2cccc(C(F)(F)F)c2F)cc1
InChIInChI=1S/C14H10F4O/c15-13-11(2-1-3-12(13)14(16,17)18)10-6-4-9(8-19)5-7-10/h1-7,19H,8H2
InChIKeyFQKDFYPCUTUVJG-UHFFFAOYSA-N
XLogP4.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.23
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol?
The IUPAC name of [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol (CID 171382914) is [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol.
What is the SMILES notation for [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol?
The canonical SMILES for [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol is OCc1ccc(-c2cccc(C(F)(F)F)c2F)cc1.
What is the InChIKey of [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol?
The InChIKey is FQKDFYPCUTUVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F4O/c15-13-11(2-1-3-12(13)14(16,17)18)10-6-4-9(8-19)5-7-10/h1-7,19H,8H2.
What are the key properties of [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol?
[4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol has a molecular weight of 270.23 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-fluoro-3-(trifluoromethyl)phenyl]phenyl]methanol is sourced from PubChem (CID 171382914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).