2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol

C15H13Cl2FO — CID 79704311

IUPAC2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
SMILESCc1cc(F)cc(C(O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C15H13Cl2FO/c1-9-4-11(6-13(18)5-9)15(19)7-10-2-3-12(16)8-14(10)17/h2-6,8,15,19H,7H2,1H3
InChIKeyVTNKWFXKJJOXGV-UHFFFAOYSA-N
MW299.17 g/mol
LogP4.72
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol

2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol (PubChem CID 79704311) has the molecular formula C15H13Cl2FO and a molecular weight of 299.17 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
PubChem CID79704311
Molecular FormulaC15H13Cl2FO
Molecular Weight299.17 g/mol
Exact Mass298.03
IUPAC Name2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
SMILESCc1cc(F)cc(C(O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C15H13Cl2FO/c1-9-4-11(6-13(18)5-9)15(19)7-10-2-3-12(16)8-14(10)17/h2-6,8,15,19H,7H2,1H3
InChIKeyVTNKWFXKJJOXGV-UHFFFAOYSA-N
XLogP4.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 107884328
2-(2,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607142
2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 62796974
1-(3-chloro-5-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105377706
1-(2-chloro-4-methylphenyl)-3-(2,4-dichlorophenyl)propan-2-ol
CID 106867255
2-(2,4-dichlorophenyl)-1-(1-methylpyrrol-3-yl)ethanol
CID 10612074
1-(3-chloro-5-fluorophenyl)-2-(2-fluorophenyl)ethanol
CID 114454010
1-(3-aminophenyl)-2-(2,4-dichlorophenyl)ethanol
CID 106695721
1,3-bis(2,4-dichlorophenyl)propan-2-ol
CID 63410533
1-(4-bromo-3-fluorophenyl)-2-(2-chloro-4-fluorophenyl)ethanol
CID 81447982
2-(2,4-dichlorophenyl)-1-[4-(difluoromethoxy)phenyl]ethanol
CID 65146137
2-(2,4-dichlorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol
CID 63410917

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol (CID 79704311) is 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol is Cc1cc(F)cc(C(O)Cc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol?
The InChIKey is VTNKWFXKJJOXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO/c1-9-4-11(6-13(18)5-9)15(19)7-10-2-3-12(16)8-14(10)17/h2-6,8,15,19H,7H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol?
2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol has a molecular weight of 299.17 g/mol, XLogP of 4.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol is sourced from PubChem (CID 79704311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).