1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol

C15H13Cl2FO2 — CID 63083648

IUPAC1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(Cl)cc1CC(O)c1ccc(Cl)cc1F
InChIInChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(16)6-9(15)7-14(19)12-4-2-11(17)8-13(12)18/h2-6,8,14,19H,7H2,1H3
InChIKeyCYFLRUHEBADWKF-UHFFFAOYSA-N
MW315.17 g/mol
LogP4.42
Rot. Bonds4

About 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol

1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol (PubChem CID 63083648) has the molecular formula C15H13Cl2FO2 and a molecular weight of 315.17 g/mol. Its IUPAC name is 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
PubChem CID63083648
Molecular FormulaC15H13Cl2FO2
Molecular Weight315.17 g/mol
Exact Mass314.03
IUPAC Name1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(Cl)cc1CC(O)c1ccc(Cl)cc1F
InChIInChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(16)6-9(15)7-14(19)12-4-2-11(17)8-13(12)18/h2-6,8,14,19H,7H2,1H3
InChIKeyCYFLRUHEBADWKF-UHFFFAOYSA-N
XLogP4.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-methoxyphenyl)-1-(2,3,4-trifluorophenyl)ethanol
CID 115788665
2-(5-chloro-2-methoxyphenyl)-1-(2,5-difluorophenyl)ethanol
CID 63661823
1-(2-chloro-3-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
CID 115788734
2-(5-chloro-2-methoxyphenyl)-1-(2-fluoro-3-methylphenyl)ethanol
CID 115788745
1-(4-bromo-2-methylphenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
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2-(5-chloro-2-methoxyphenyl)-1-(2,3-dichlorophenyl)ethanol
CID 65148612
1-(5-chloro-2-fluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 55151769
2-(5-chloro-2-methoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62607764
2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-methoxyphenyl)ethanol
CID 82802069
1-(3-bromo-5-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol
CID 66425619
1-(4-chloro-2-methoxyphenyl)-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 115782250
1-(4-bromo-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanamine
CID 114905993

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol (CID 63083648) is 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol is COc1ccc(Cl)cc1CC(O)c1ccc(Cl)cc1F.
What is the InChIKey of 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol?
The InChIKey is CYFLRUHEBADWKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(16)6-9(15)7-14(19)12-4-2-11(17)8-13(12)18/h2-6,8,14,19H,7H2,1H3.
What are the key properties of 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol?
1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol has a molecular weight of 315.17 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethanol is sourced from PubChem (CID 63083648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).