[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol

C15H13F3O — CID 115527738

IUPAC[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2cccc(C(F)F)c2)c1
InChIInChI=1S/C15H13F3O/c1-9-5-6-13(16)12(7-9)14(19)10-3-2-4-11(8-10)15(17)18/h2-8,14-15,19H,1H3
InChIKeyQQEXZWZYTXAZKN-UHFFFAOYSA-N
MW266.26 g/mol
LogP4.15
Rot. Bonds3

About [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol

[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol (PubChem CID 115527738) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol
PubChem CID115527738
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2cccc(C(F)F)c2)c1
InChIInChI=1S/C15H13F3O/c1-9-5-6-13(16)12(7-9)14(19)10-3-2-4-11(8-10)15(17)18/h2-8,14-15,19H,1H3
InChIKeyQQEXZWZYTXAZKN-UHFFFAOYSA-N
XLogP4.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(difluoromethyl)phenyl]-(2,4-dimethylphenyl)methanol
CID 115527668
[3-(dimethylamino)phenyl]-(2-fluoro-5-methylphenyl)methanol
CID 105094125
(2-fluoro-5-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 62791138
3-[(2-fluoro-5-methylphenyl)-hydroxymethyl]benzonitrile
CID 113318876
(2-fluoro-5-methylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 62790310
(2,3-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63894755
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol
CID 105489348
(2-bromo-6-fluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 114885762
(3,4-difluorophenyl)-(3-methylphenyl)methanol
CID 2758296
(2-fluoro-5-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 62509973
(2-fluoro-5-methylphenyl)-(2-iodophenyl)methanol
CID 115794497

Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol?
The IUPAC name of [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol (CID 115527738) is [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol?
The canonical SMILES for [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol is Cc1ccc(F)c(C(O)c2cccc(C(F)F)c2)c1.
What is the InChIKey of [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol?
The InChIKey is QQEXZWZYTXAZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-9-5-6-13(16)12(7-9)14(19)10-3-2-4-11(8-10)15(17)18/h2-8,14-15,19H,1H3.
What are the key properties of [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol?
[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol has a molecular weight of 266.26 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 115527738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).