(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol

C15H14ClFO2 — CID 115823109

IUPAC(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
SMILESCOc1cc(Cl)ccc1C(O)c1cc(C)cc(F)c1
InChIInChI=1S/C15H14ClFO2/c1-9-5-10(7-12(17)6-9)15(18)13-4-3-11(16)8-14(13)19-2/h3-8,15,18H,1-2H3
InChIKeyUCTCWLIICBLFLF-UHFFFAOYSA-N
MW280.73 g/mol
LogP3.88
Rot. Bonds3

About (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol

(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol (PubChem CID 115823109) has the molecular formula C15H14ClFO2 and a molecular weight of 280.73 g/mol. Its IUPAC name is (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
PubChem CID115823109
Molecular FormulaC15H14ClFO2
Molecular Weight280.73 g/mol
Exact Mass280.07
IUPAC Name(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
SMILESCOc1cc(Cl)ccc1C(O)c1cc(C)cc(F)c1
InChIInChI=1S/C15H14ClFO2/c1-9-5-10(7-12(17)6-9)15(18)13-4-3-11(16)8-14(13)19-2/h3-8,15,18H,1-2H3
InChIKeyUCTCWLIICBLFLF-UHFFFAOYSA-N
XLogP3.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanamine
CID 105016596
(4-bromo-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823095
(4-chloro-2-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 115821652
(3,5-dimethylphenyl)-(2-methoxy-4-methylphenyl)methanol
CID 106790985
(3-chloro-5-methylphenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanol
CID 81316466
(4-chloro-2-methoxyphenyl)-(3-chloro-4-methylphenyl)methanol
CID 107560197
(4-chloro-2-methoxyphenyl)-(2,6-difluoro-3-methylphenyl)methanol
CID 115829313
(4-chloro-2-methoxyphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 115793883
(4-chloro-2-methoxyphenyl)-(3,5-difluorophenyl)methanamine
CID 115851745
(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433209
(2-chloro-5-fluorophenyl)-(3-fluoro-5-methylphenyl)methanol
CID 105394565
(3-fluoro-5-methylphenyl)-(4-methoxyphenyl)methanol
CID 79691470

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol?
The IUPAC name of (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol (CID 115823109) is (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol?
The canonical SMILES for (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol is COc1cc(Cl)ccc1C(O)c1cc(C)cc(F)c1.
What is the InChIKey of (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol?
The InChIKey is UCTCWLIICBLFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO2/c1-9-5-10(7-12(17)6-9)15(18)13-4-3-11(16)8-14(13)19-2/h3-8,15,18H,1-2H3.
What are the key properties of (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol?
(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol has a molecular weight of 280.73 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 115823109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).