1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one

C15H13ClO2 — CID 102075278

IUPAC1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one
SMILESCC(C(=O)c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C15H13ClO2/c1-10(13-4-2-3-5-14(13)17)15(18)11-6-8-12(16)9-7-11/h2-10,17H,1H3
InChIKeyDLOVLPGGPLLITI-UHFFFAOYSA-N
MW260.72 g/mol
LogP4.03
Rot. Bonds3

About 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one

1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one (PubChem CID 102075278) has the molecular formula C15H13ClO2 and a molecular weight of 260.72 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one
PubChem CID102075278
Molecular FormulaC15H13ClO2
Molecular Weight260.72 g/mol
Exact Mass260.06
IUPAC Name1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one
SMILESCC(C(=O)c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C15H13ClO2/c1-10(13-4-2-3-5-14(13)17)15(18)11-6-8-12(16)9-7-11/h2-10,17H,1H3
InChIKeyDLOVLPGGPLLITI-UHFFFAOYSA-N
XLogP4.03
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one?
The IUPAC name of 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one (CID 102075278) is 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one?
The canonical SMILES for 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one is CC(C(=O)c1ccc(Cl)cc1)c1ccccc1O.
What is the InChIKey of 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one?
The InChIKey is DLOVLPGGPLLITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO2/c1-10(13-4-2-3-5-14(13)17)15(18)11-6-8-12(16)9-7-11/h2-10,17H,1H3.
What are the key properties of 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one?
1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one has a molecular weight of 260.72 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(2-hydroxyphenyl)propan-1-one is sourced from PubChem (CID 102075278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).