(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol

C15H14ClFO2 — CID 61081454

IUPAC(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2cc(Cl)ccc2F)cc1C
InChIInChI=1S/C15H14ClFO2/c1-9-7-10(3-6-14(9)19-2)15(18)12-8-11(16)4-5-13(12)17/h3-8,15,18H,1-2H3
InChIKeyPHFPVZXAWTVCAV-UHFFFAOYSA-N
MW280.73 g/mol
LogP3.88
Rot. Bonds3

About (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol

(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol (PubChem CID 61081454) has the molecular formula C15H14ClFO2 and a molecular weight of 280.73 g/mol. Its IUPAC name is (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
PubChem CID61081454
Molecular FormulaC15H14ClFO2
Molecular Weight280.73 g/mol
Exact Mass280.07
IUPAC Name(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2cc(Cl)ccc2F)cc1C
InChIInChI=1S/C15H14ClFO2/c1-9-7-10(3-6-14(9)19-2)15(18)12-8-11(16)4-5-13(12)17/h3-8,15,18H,1-2H3
InChIKeyPHFPVZXAWTVCAV-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

(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
4-chloro-2-[chloro-(4-methoxy-3-methylphenyl)methyl]-1-fluorobenzene
CID 63434447
(4-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 63895530
(5-chloro-2-fluorophenyl)-(4,5-dimethoxy-2-methylphenyl)methanol
CID 61080574
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
CID 61100029
(5-chloro-2-methoxyphenyl)-[4-(difluoromethyl)phenyl]methanol
CID 115525000
(2,4-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61083249
(2-chloro-6-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61082454
(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843
(5-chloro-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 61087442
(5-bromo-2-chlorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61082254
(3-chloro-4-methylphenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanol
CID 63194903

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol?
The IUPAC name of (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol (CID 61081454) is (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol.
What is the SMILES notation for (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol?
The canonical SMILES for (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol is COc1ccc(C(O)c2cc(Cl)ccc2F)cc1C.
What is the InChIKey of (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol?
The InChIKey is PHFPVZXAWTVCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO2/c1-9-7-10(3-6-14(9)19-2)15(18)12-8-11(16)4-5-13(12)17/h3-8,15,18H,1-2H3.
What are the key properties of (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol?
(5-chloro-2-fluorophenyl)-(4-methoxy-3-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 (5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol is sourced from PubChem (CID 61081454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).