1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol

C15H13F3O — CID 25233734

IUPAC1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1ccccc1C(F)(F)F)c1ccccc1
InChIInChI=1S/C15H13F3O/c16-15(17,18)13-9-5-4-8-12(13)10-14(19)11-6-2-1-3-7-11/h1-9,14,19H,10H2
InChIKeyFTGTVRDCNXKJSF-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.98
Rot. Bonds3

About 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol

1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol (PubChem CID 25233734) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol
PubChem CID25233734
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1ccccc1C(F)(F)F)c1ccccc1
InChIInChI=1S/C15H13F3O/c16-15(17,18)13-9-5-4-8-12(13)10-14(19)11-6-2-1-3-7-11/h1-9,14,19H,10H2
InChIKeyFTGTVRDCNXKJSF-UHFFFAOYSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol (CID 25233734) is 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol is OC(Cc1ccccc1C(F)(F)F)c1ccccc1.
What is the InChIKey of 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol?
The InChIKey is FTGTVRDCNXKJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c16-15(17,18)13-9-5-4-8-12(13)10-14(19)11-6-2-1-3-7-11/h1-9,14,19H,10H2.
What are the key properties of 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol?
1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol has a molecular weight of 266.26 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-[2-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 25233734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).