1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol

C16H14F4O — CID 65150144

IUPAC1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
SMILESCc1cc(F)ccc1C(O)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H14F4O/c1-10-7-13(17)5-6-14(10)15(21)9-11-3-2-4-12(8-11)16(18,19)20/h2-8,15,21H,9H2,1H3
InChIKeyPHNOVIVIRZLNBY-UHFFFAOYSA-N
MW298.28 g/mol
LogP4.43
Rot. Bonds3

About 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol

1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol (PubChem CID 65150144) has the molecular formula C16H14F4O and a molecular weight of 298.28 g/mol. Its IUPAC name is 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
PubChem CID65150144
Molecular FormulaC16H14F4O
Molecular Weight298.28 g/mol
Exact Mass298.10
IUPAC Name1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
SMILESCc1cc(F)ccc1C(O)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H14F4O/c1-10-7-13(17)5-6-14(10)15(21)9-11-3-2-4-12(8-11)16(18,19)20/h2-8,15,21H,9H2,1H3
InChIKeyPHNOVIVIRZLNBY-UHFFFAOYSA-N
XLogP4.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluoro-2-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 55115802
1-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
CID 63084701
2-(4-tert-butylphenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 65150242
2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 107883556
1-(4-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanol
CID 65149639
1-(4-methylphenyl)-3-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 62607876
(1S)-1-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]ethanol
CID 121456490
1-(4-fluoro-2-methylphenyl)-3-(3-methylphenyl)propan-1-ol
CID 105093937
(1S)-1-(4-fluoro-2-methylphenyl)propan-1-ol
CID 79002158
2-(3-bromo-5-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 79702447
2-(3-bromophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 55135398
2-(3-chlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62387586

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol (CID 65150144) is 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol is Cc1cc(F)ccc1C(O)Cc1cccc(C(F)(F)F)c1.
What is the InChIKey of 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
The InChIKey is PHNOVIVIRZLNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F4O/c1-10-7-13(17)5-6-14(10)15(21)9-11-3-2-4-12(8-11)16(18,19)20/h2-8,15,21H,9H2,1H3.
What are the key properties of 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol?
1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol has a molecular weight of 298.28 g/mol, XLogP of 4.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 65150144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).