2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol

C15H13Cl2FO2 — CID 62796974

IUPAC2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccc(Cl)cc2Cl)cc1F
InChIInChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(6-13(15)18)14(19)7-9-2-4-11(16)8-12(9)17/h2-6,8,14,19H,7H2,1H3
InChIKeyZPMNYQDTABWSGF-UHFFFAOYSA-N
MW315.17 g/mol
LogP4.42
Rot. Bonds4

About 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol

2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol (PubChem CID 62796974) has the molecular formula C15H13Cl2FO2 and a molecular weight of 315.17 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
PubChem CID62796974
Molecular FormulaC15H13Cl2FO2
Molecular Weight315.17 g/mol
Exact Mass314.03
IUPAC Name2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccc(Cl)cc2Cl)cc1F
InChIInChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(6-13(15)18)14(19)7-9-2-4-11(16)8-12(9)17/h2-6,8,14,19H,7H2,1H3
InChIKeyZPMNYQDTABWSGF-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-(2-chloro-4-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 63035615
2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 62797331
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 107307527
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 65101453
(2,4-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61083249
2-(5-chloro-2-methoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62607764
(3-chloro-4-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 63094497
(1R)-2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 83000611
2-amino-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 13079645
1-(3,4-difluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 61089068
2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79704311
1-(3-fluoro-4-methoxyphenyl)pentane-1,5-diol
CID 112509946

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol (CID 62796974) is 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol is COc1ccc(C(O)Cc2ccc(Cl)cc2Cl)cc1F.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol?
The InChIKey is ZPMNYQDTABWSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO2/c1-20-15-5-3-10(6-13(15)18)14(19)7-9-2-4-11(16)8-12(9)17/h2-6,8,14,19H,7H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol?
2-(2,4-dichlorophenyl)-1-(3-fluoro-4-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 2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol is sourced from PubChem (CID 62796974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).