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

C15H12F4O — CID 62787437

IUPAC1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
SMILESCC(O)(c1cccc(F)c1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H12F4O/c1-14(20,11-5-3-7-13(16)9-11)10-4-2-6-12(8-10)15(17,18)19/h2-9,20H,1H3
InChIKeyQEMBZHBXMOLLGF-UHFFFAOYSA-N
MW284.25 g/mol
LogP4.10
Rot. Bonds2

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

1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol (PubChem CID 62787437) has the molecular formula C15H12F4O and a molecular weight of 284.25 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
PubChem CID62787437
Molecular FormulaC15H12F4O
Molecular Weight284.25 g/mol
Exact Mass284.08
IUPAC Name1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
SMILESCC(O)(c1cccc(F)c1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H12F4O/c1-14(20,11-5-3-7-13(16)9-11)10-4-2-6-12(8-10)15(17,18)19/h2-9,20H,1H3
InChIKeyQEMBZHBXMOLLGF-UHFFFAOYSA-N
XLogP4.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.25
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-fluorophenyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanol
CID 107287061
1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 114872417
1-(3-bromophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 62787446
1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
CID 62787951
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
actinium;1-[3,5-bis(trifluoromethyl)phenyl]-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethanol
CID 22950157
1-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62787268
1,1,2,2-tetrakis[3-(trifluoromethyl)phenyl]ethane-1,2-diol
CID 3857608
1-(3,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62786600
1-(3-fluorophenyl)-1-[2-(trifluoromethoxy)phenyl]ethanol
CID 62787438
1-[difluoro-(3-fluorophenyl)methyl]-3-fluorobenzene
CID 70952663
(2S)-2-(3-fluorophenyl)-2-hydroxypropanenitrile
CID 98747909

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol (CID 62787437) is 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol is CC(O)(c1cccc(F)c1)c1cccc(C(F)(F)F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol?
The InChIKey is QEMBZHBXMOLLGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F4O/c1-14(20,11-5-3-7-13(16)9-11)10-4-2-6-12(8-10)15(17,18)19/h2-9,20H,1H3.
What are the key properties of 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol?
1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol has a molecular weight of 284.25 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 62787437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).