bis(4-fluoro-2-methylphenyl)methanol

C15H14F2O — CID 14371387

IUPACbis(4-fluoro-2-methylphenyl)methanol
SMILESCc1cc(F)ccc1C(O)c1ccc(F)cc1C
InChIInChI=1S/C15H14F2O/c1-9-7-11(16)3-5-13(9)15(18)14-6-4-12(17)8-10(14)2/h3-8,15,18H,1-2H3
InChIKeyCXZXAFFPRWIDTH-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.66
Rot. Bonds2

About bis(4-fluoro-2-methylphenyl)methanol

bis(4-fluoro-2-methylphenyl)methanol (PubChem CID 14371387) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is bis(4-fluoro-2-methylphenyl)methanol.

Molecular Properties

Compound Namebis(4-fluoro-2-methylphenyl)methanol
PubChem CID14371387
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Namebis(4-fluoro-2-methylphenyl)methanol
SMILESCc1cc(F)ccc1C(O)c1ccc(F)cc1C
InChIInChI=1S/C15H14F2O/c1-9-7-11(16)3-5-13(9)15(18)14-6-4-12(17)8-10(14)2/h3-8,15,18H,1-2H3
InChIKeyCXZXAFFPRWIDTH-UHFFFAOYSA-N
XLogP3.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bis(4-fluoro-2-methylphenyl)methanol?
The IUPAC name of bis(4-fluoro-2-methylphenyl)methanol (CID 14371387) is bis(4-fluoro-2-methylphenyl)methanol.
What is the SMILES notation for bis(4-fluoro-2-methylphenyl)methanol?
The canonical SMILES for bis(4-fluoro-2-methylphenyl)methanol is Cc1cc(F)ccc1C(O)c1ccc(F)cc1C.
What is the InChIKey of bis(4-fluoro-2-methylphenyl)methanol?
The InChIKey is CXZXAFFPRWIDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-9-7-11(16)3-5-13(9)15(18)14-6-4-12(17)8-10(14)2/h3-8,15,18H,1-2H3.
What are the key properties of bis(4-fluoro-2-methylphenyl)methanol?
bis(4-fluoro-2-methylphenyl)methanol has a molecular weight of 248.27 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-fluoro-2-methylphenyl)methanol is sourced from PubChem (CID 14371387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).