2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol

C15H13ClF2O — CID 114833204

IUPAC2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1ccc(Cl)cc1F
InChIInChI=1S/C15H13ClF2O/c1-15(19,9-10-2-5-12(17)6-3-10)13-7-4-11(16)8-14(13)18/h2-8,19H,9H2,1H3
InChIKeyFZDKFLRFNIXLET-UHFFFAOYSA-N
MW282.72 g/mol
LogP4.07
Rot. Bonds3

About 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol

2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol (PubChem CID 114833204) has the molecular formula C15H13ClF2O and a molecular weight of 282.72 g/mol. Its IUPAC name is 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol
PubChem CID114833204
Molecular FormulaC15H13ClF2O
Molecular Weight282.72 g/mol
Exact Mass282.06
IUPAC Name2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1ccc(Cl)cc1F
InChIInChI=1S/C15H13ClF2O/c1-15(19,9-10-2-5-12(17)6-3-10)13-7-4-11(16)8-14(13)18/h2-8,19H,9H2,1H3
InChIKeyFZDKFLRFNIXLET-UHFFFAOYSA-N
XLogP4.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.72
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol?
The IUPAC name of 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol (CID 114833204) is 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol.
What is the SMILES notation for 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol?
The canonical SMILES for 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol is CC(O)(Cc1ccc(F)cc1)c1ccc(Cl)cc1F.
What is the InChIKey of 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol?
The InChIKey is FZDKFLRFNIXLET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2O/c1-15(19,9-10-2-5-12(17)6-3-10)13-7-4-11(16)8-14(13)18/h2-8,19H,9H2,1H3.
What are the key properties of 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol?
2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol has a molecular weight of 282.72 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol is sourced from PubChem (CID 114833204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).