1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol

C15H14ClFO2 — CID 63017689

IUPAC1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H14ClFO2/c1-19-12-5-2-10(3-6-12)8-15(18)13-7-4-11(17)9-14(13)16/h2-7,9,15,18H,8H2,1H3
InChIKeyLQWZDXZGMZIGFH-UHFFFAOYSA-N
MW280.73 g/mol
LogP3.76
Rot. Bonds4

About 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol

1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol (PubChem CID 63017689) has the molecular formula C15H14ClFO2 and a molecular weight of 280.73 g/mol. Its IUPAC name is 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol
PubChem CID63017689
Molecular FormulaC15H14ClFO2
Molecular Weight280.73 g/mol
Exact Mass280.07
IUPAC Name1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H14ClFO2/c1-19-12-5-2-10(3-6-12)8-15(18)13-7-4-11(17)9-14(13)16/h2-7,9,15,18H,8H2,1H3
InChIKeyLQWZDXZGMZIGFH-UHFFFAOYSA-N
XLogP3.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4-methylphenyl)-2-(4-methoxyphenyl)ethanol
CID 106863705
2-(4-tert-butylphenyl)-1-(2-chloro-4-fluorophenyl)ethanol
CID 63411155
1-(2,5-dichlorothiophen-3-yl)-2-(4-methoxyphenyl)ethanol
CID 61081417
2-(3,4-dichlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanol
CID 63047363
1-(2-chloro-4-fluorophenyl)-4-(4-methoxyphenyl)butan-2-ol
CID 65444557
2-chloro-1-[chloro-(4-methoxyphenyl)methyl]-4-fluorobenzene
CID 63429186
1-(4-bromo-2-chlorophenyl)-2-(4-fluorophenyl)ethanol
CID 55150652
1-(2-chloro-5-fluorophenyl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 105394780
[1-(2-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)propan-2-yl]hydrazine
CID 105205338
N-[1-(2-chloro-4-fluorophenyl)ethyl]-4-methoxyaniline
CID 43766019
1-(2,6-dichlorophenyl)-2-(4-methoxyphenyl)ethanol
CID 63018440
2-(3,5-difluorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanol
CID 105405786

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol?
The IUPAC name of 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol (CID 63017689) is 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol is COc1ccc(CC(O)c2ccc(F)cc2Cl)cc1.
What is the InChIKey of 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol?
The InChIKey is LQWZDXZGMZIGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO2/c1-19-12-5-2-10(3-6-12)8-15(18)13-7-4-11(17)9-14(13)16/h2-7,9,15,18H,8H2,1H3.
What are the key properties of 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol?
1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol has a molecular weight of 280.73 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 63017689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).