1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol

C15H12F4O — CID 63084701

IUPAC1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1cccc(C(F)(F)F)c1)c1ccccc1F
InChIInChI=1S/C15H12F4O/c16-13-7-2-1-6-12(13)14(20)9-10-4-3-5-11(8-10)15(17,18)19/h1-8,14,20H,9H2
InChIKeyLJIBIUOMCASDQJ-UHFFFAOYSA-N
MW284.25 g/mol
LogP4.12
Rot. Bonds3

About 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol

1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol (PubChem CID 63084701) has the molecular formula C15H12F4O and a molecular weight of 284.25 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
PubChem CID63084701
Molecular FormulaC15H12F4O
Molecular Weight284.25 g/mol
Exact Mass284.08
IUPAC Name1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1cccc(C(F)(F)F)c1)c1ccccc1F
InChIInChI=1S/C15H12F4O/c16-13-7-2-1-6-12(13)14(20)9-10-4-3-5-11(8-10)15(17,18)19/h1-8,14,20H,9H2
InChIKeyLJIBIUOMCASDQJ-UHFFFAOYSA-N
XLogP4.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.25
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
CID 65150144
(1S)-1-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
CID 121456490
(2R)-1-chloro-3-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 58689696
2-bromo-3-[3-(trifluoromethyl)phenyl]propanamide
CID 104513003
1-(4-methylphenyl)-3-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 62607876
3-methoxy-1-[3-(trifluoromethyl)phenyl]butan-2-ol
CID 79617375
4-[1-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl]benzonitrile
CID 115481025
1-chloro-2-[1-chloro-3-[3-(trifluoromethyl)phenyl]propan-2-yl]benzene
CID 79437571
2-iodo-N-[(1R)-1-naphthalen-1-ylethyl]-3-[3-(trifluoromethyl)phenyl]propanamide
CID 24854936
1-(2-iodopropyl)-3-(trifluoromethyl)benzene
CID 135032501
1-(2-bromopropyl)-3-(trifluoromethyl)benzene
CID 14025642
[(2R)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]azanium
CID 38988975

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol (CID 63084701) is 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol is OC(Cc1cccc(C(F)(F)F)c1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The InChIKey is LJIBIUOMCASDQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F4O/c16-13-7-2-1-6-12(13)14(20)9-10-4-3-5-11(8-10)15(17,18)19/h1-8,14,20H,9H2.
What are the key properties of 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol has a molecular weight of 284.25 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 63084701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).