1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol

C15H13Cl2FO — CID 60798841

IUPAC1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol
SMILESOC(Cc1ccccc1F)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl2FO/c16-12-6-5-10(14(17)9-12)7-13(19)8-11-3-1-2-4-15(11)18/h1-6,9,13,19H,7-8H2
InChIKeyOJCCXILOBQQTOC-UHFFFAOYSA-N
MW299.17 g/mol
LogP4.28
Rot. Bonds4

About 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol

1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol (PubChem CID 60798841) has the molecular formula C15H13Cl2FO and a molecular weight of 299.17 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol
PubChem CID60798841
Molecular FormulaC15H13Cl2FO
Molecular Weight299.17 g/mol
Exact Mass298.03
IUPAC Name1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol
SMILESOC(Cc1ccccc1F)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl2FO/c16-12-6-5-10(14(17)9-12)7-13(19)8-11-3-1-2-4-15(11)18/h1-6,9,13,19H,7-8H2
InChIKeyOJCCXILOBQQTOC-UHFFFAOYSA-N
XLogP4.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chlorophenyl)-3-(2-fluorophenyl)propan-2-ol
CID 54978146
1,3-bis(2,4-dichlorophenyl)propan-2-ol
CID 63410533
1-(2,4-dichlorophenyl)-3-(3,4-difluorophenyl)propan-2-ol
CID 82920805
1-(2,4-dichlorophenyl)butan-2-ol;methanol
CID 144705825
1-(2-chloro-4-methylphenyl)-3-(2,4-dichlorophenyl)propan-2-ol
CID 106867255
1-(2,5-dichlorophenyl)-2-(2-fluorophenyl)ethanol
CID 61082200
2-(2,4-dichlorophenyl)-1-(2-fluorophenyl)ethanamine
CID 62502807
1-(2-chloro-3-fluorophenyl)-3-(2-chlorophenyl)propan-2-ol
CID 112653439
1-(4-chloro-2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 114854536
1-(2,3-difluorophenyl)-3-(2-fluorophenyl)propan-2-ol
CID 55095617
1-(3-bromo-5-fluorophenyl)-3-(2,4-dichlorophenyl)propan-2-ol
CID 79701916
1-(2,4-dichlorophenyl)pentan-2-ol
CID 60798287

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol (CID 60798841) is 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol is OC(Cc1ccccc1F)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol?
The InChIKey is OJCCXILOBQQTOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO/c16-12-6-5-10(14(17)9-12)7-13(19)8-11-3-1-2-4-15(11)18/h1-6,9,13,19H,7-8H2.
What are the key properties of 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol?
1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol has a molecular weight of 299.17 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-3-(2-fluorophenyl)propan-2-ol is sourced from PubChem (CID 60798841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).