2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol

C15H14F2O — CID 159994137

IUPAC2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol
SMILESCc1ccc(-c2ccc(C(O)C(F)F)cc2)cc1
InChIInChI=1S/C15H14F2O/c1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)14(18)15(16)17/h2-9,14-15,18H,1H3
InChIKeyOHIDJIYEFIYTMY-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.96
Rot. Bonds3

About 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol

2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol (PubChem CID 159994137) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol.

Molecular Properties

Compound Name2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol
PubChem CID159994137
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol
SMILESCc1ccc(-c2ccc(C(O)C(F)F)cc2)cc1
InChIInChI=1S/C15H14F2O/c1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)14(18)15(16)17/h2-9,14-15,18H,1H3
InChIKeyOHIDJIYEFIYTMY-UHFFFAOYSA-N
XLogP3.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-[4-(4-bromophenyl)phenyl]-2,2-difluoroethanol
CID 15942068
(4-methylphenyl)-[4-(4-methylphenyl)phenyl]methanol
CID 143325793
1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol
CID 154573668
(1R)-2,2-difluoro-1-phenylethanol
CID 12955760
2,2-difluoro-1-[4-(trifluoromethyl)phenyl]ethanol
CID 79016422
1-(4-ethoxyphenyl)-2,2-difluoroethanol
CID 80604264
2,3-dihydroxy-3-(4-methylphenyl)propanenitrile
CID 171869656
(1S,2R,3S)-2-methyl-1-(4-methylphenyl)-3-[4-(trifluoromethyl)phenyl]propane-1,3-diol
CID 102071267
2-(ethylamino)-1-(4-methylphenyl)propan-1-ol;hydrochloride
CID 76974190
[fluoro-(4-methylphenyl)methyl]phosphane
CID 144982397
amino-(4-methylphenyl)methanol
CID 70304176
cyclopropyl-[4-(4-methylphenyl)phenyl]methanol
CID 175668827

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol?
The IUPAC name of 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol (CID 159994137) is 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol.
What is the SMILES notation for 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol?
The canonical SMILES for 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol is Cc1ccc(-c2ccc(C(O)C(F)F)cc2)cc1.
What is the InChIKey of 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol?
The InChIKey is OHIDJIYEFIYTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)14(18)15(16)17/h2-9,14-15,18H,1H3.
What are the key properties of 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol?
2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol has a molecular weight of 248.27 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol is sourced from PubChem (CID 159994137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).