[3-phenyl-2-(trifluoromethoxy)phenyl]methanol

C14H11F3O2 — CID 174537079

IUPAC[3-phenyl-2-(trifluoromethoxy)phenyl]methanol
SMILESOCc1cccc(-c2ccccc2)c1OC(F)(F)F
InChIInChI=1S/C14H11F3O2/c15-14(16,17)19-13-11(9-18)7-4-8-12(13)10-5-2-1-3-6-10/h1-8,18H,9H2
InChIKeyAKUWOCXMFTUKMM-UHFFFAOYSA-N
MW268.23 g/mol
LogP3.74
Rot. Bonds3

About [3-phenyl-2-(trifluoromethoxy)phenyl]methanol

[3-phenyl-2-(trifluoromethoxy)phenyl]methanol (PubChem CID 174537079) has the molecular formula C14H11F3O2 and a molecular weight of 268.23 g/mol. Its IUPAC name is [3-phenyl-2-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-phenyl-2-(trifluoromethoxy)phenyl]methanol
PubChem CID174537079
Molecular FormulaC14H11F3O2
Molecular Weight268.23 g/mol
Exact Mass268.07
IUPAC Name[3-phenyl-2-(trifluoromethoxy)phenyl]methanol
SMILESOCc1cccc(-c2ccccc2)c1OC(F)(F)F
InChIInChI=1S/C14H11F3O2/c15-14(16,17)19-13-11(9-18)7-4-8-12(13)10-5-2-1-3-6-10/h1-8,18H,9H2
InChIKeyAKUWOCXMFTUKMM-UHFFFAOYSA-N
XLogP3.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.23
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-phenyl-2-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of [3-phenyl-2-(trifluoromethoxy)phenyl]methanol (CID 174537079) is [3-phenyl-2-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for [3-phenyl-2-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for [3-phenyl-2-(trifluoromethoxy)phenyl]methanol is OCc1cccc(-c2ccccc2)c1OC(F)(F)F.
What is the InChIKey of [3-phenyl-2-(trifluoromethoxy)phenyl]methanol?
The InChIKey is AKUWOCXMFTUKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3O2/c15-14(16,17)19-13-11(9-18)7-4-8-12(13)10-5-2-1-3-6-10/h1-8,18H,9H2.
What are the key properties of [3-phenyl-2-(trifluoromethoxy)phenyl]methanol?
[3-phenyl-2-(trifluoromethoxy)phenyl]methanol has a molecular weight of 268.23 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-phenyl-2-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 174537079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).