(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol

C15H13ClF2O — CID 106880575

IUPAC(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(F)cc(Cl)c2)c(F)c1
InChIInChI=1S/C15H13ClF2O/c1-8-3-9(2)14(13(18)4-8)15(19)10-5-11(16)7-12(17)6-10/h3-7,15,19H,1-2H3
InChIKeyZGQWWTUUPVVUKK-UHFFFAOYSA-N
MW282.72 g/mol
LogP4.32
Rot. Bonds2

About (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol

(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol (PubChem CID 106880575) has the molecular formula C15H13ClF2O and a molecular weight of 282.72 g/mol. Its IUPAC name is (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol.

Molecular Properties

Compound Name(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
PubChem CID106880575
Molecular FormulaC15H13ClF2O
Molecular Weight282.72 g/mol
Exact Mass282.06
IUPAC Name(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(F)cc(Cl)c2)c(F)c1
InChIInChI=1S/C15H13ClF2O/c1-8-3-9(2)14(13(18)4-8)15(19)10-5-11(16)7-12(17)6-10/h3-7,15,19H,1-2H3
InChIKeyZGQWWTUUPVVUKK-UHFFFAOYSA-N
XLogP4.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.72
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4-bromo-3-chlorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884138
(2,5-dichlorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884176
(5-chloro-2-pyridinyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106881129
(2,6-dichlorophenyl)-(3-fluoro-5-methylphenyl)methanol
CID 79690334
(3-chloro-4-fluorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879411
(4-fluoro-2,6-dimethylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 106879405
(3-bromo-5-methylphenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879416
(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 106884178
(3-chloro-5-methylphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
CID 106877482
2-(4-chlorophenyl)sulfanyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106881089
(R)-(3-chloro-5-fluorophenyl)-(3-fluorophenyl)methanol
CID 7146499
(3,5-dichlorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 63899311

Frequently Asked Questions

What is the IUPAC name of (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol?
The IUPAC name of (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol (CID 106880575) is (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol.
What is the SMILES notation for (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol?
The canonical SMILES for (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol is Cc1cc(C)c(C(O)c2cc(F)cc(Cl)c2)c(F)c1.
What is the InChIKey of (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol?
The InChIKey is ZGQWWTUUPVVUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2O/c1-8-3-9(2)14(13(18)4-8)15(19)10-5-11(16)7-12(17)6-10/h3-7,15,19H,1-2H3.
What are the key properties of (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol?
(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol has a molecular weight of 282.72 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol is sourced from PubChem (CID 106880575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).