1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone

C15H13ClO3 — CID 141334810

IUPAC1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone
SMILESO=C(CO)c1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C15H13ClO3/c16-12-7-5-11(6-8-12)10-19-15-4-2-1-3-13(15)14(18)9-17/h1-8,17H,9-10H2
InChIKeyJYVYFHWMFPEFOX-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.09
Rot. Bonds5

About 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone

1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone (PubChem CID 141334810) has the molecular formula C15H13ClO3 and a molecular weight of 276.72 g/mol. Its IUPAC name is 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone.

Molecular Properties

Compound Name1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone
PubChem CID141334810
Molecular FormulaC15H13ClO3
Molecular Weight276.72 g/mol
Exact Mass276.06
IUPAC Name1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone
SMILESO=C(CO)c1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C15H13ClO3/c16-12-7-5-11(6-8-12)10-19-15-4-2-1-3-13(15)14(18)9-17/h1-8,17H,9-10H2
InChIKeyJYVYFHWMFPEFOX-UHFFFAOYSA-N
XLogP3.09
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)methoxy]benzoic acid
CID 2360737
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 2763955
2-[(4-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 9402900
N-(2-chlorophenyl)-2-[(4-chlorophenyl)methoxy]benzamide
CID 7947681
(4-methylphenyl) 2-[(4-chlorophenyl)methoxy]benzoate
CID 7901065
2-[[2-[(4-chlorophenyl)methoxy]benzoyl]amino]-N-methylbenzamide
CID 16566015
2-[(4-chlorophenyl)methoxy]-N-(2-methylbutan-2-yl)benzamide
CID 2115327
1-tert-butyl-2-[(4-chlorophenyl)methoxy]benzene
CID 19165261
2-bromo-1-(2-phenylmethoxyphenyl)ethanone
CID 12541850
2-[2-(2-hydroxyacetyl)phenoxy]acetic acid
CID 23600039
2-phenylmethoxybenzoyl chloride
CID 10999355
[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl] 2-[(4-chlorophenyl)methoxy]benzoate
CID 7853325

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone?
The IUPAC name of 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone (CID 141334810) is 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone.
What is the SMILES notation for 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone?
The canonical SMILES for 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone is O=C(CO)c1ccccc1OCc1ccc(Cl)cc1.
What is the InChIKey of 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone?
The InChIKey is JYVYFHWMFPEFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO3/c16-12-7-5-11(6-8-12)10-19-15-4-2-1-3-13(15)14(18)9-17/h1-8,17H,9-10H2.
What are the key properties of 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone?
1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone has a molecular weight of 276.72 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(4-chlorophenyl)methoxy]phenyl]-2-hydroxyethanone is sourced from PubChem (CID 141334810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).