1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone

C15H14O4 — CID 12541853

IUPAC1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone
SMILESCOc1ccc(C(=O)COc2ccccc2)c(O)c1
InChIInChI=1S/C15H14O4/c1-18-12-7-8-13(14(16)9-12)15(17)10-19-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3
InChIKeyUBWQNOKFGMXMTI-UHFFFAOYSA-N
MW258.27 g/mol
LogP2.66
Rot. Bonds5

About 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone

1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone (PubChem CID 12541853) has the molecular formula C15H14O4 and a molecular weight of 258.27 g/mol. Its IUPAC name is 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone.

Molecular Properties

Compound Name1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone
PubChem CID12541853
Molecular FormulaC15H14O4
Molecular Weight258.27 g/mol
Exact Mass258.09
IUPAC Name1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone
SMILESCOc1ccc(C(=O)COc2ccccc2)c(O)c1
InChIInChI=1S/C15H14O4/c1-18-12-7-8-13(14(16)9-12)15(17)10-19-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3
InChIKeyUBWQNOKFGMXMTI-UHFFFAOYSA-N
XLogP2.66
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxy-4-methoxyphenyl)-3-phenylpropane-1,3-dione
CID 11414548
1-(2,4-dihydroxyphenyl)-2-(4-ethoxyphenoxy)ethanone
CID 678669
1-(2-fluoro-4-methoxyphenyl)-2-(4-methoxyphenoxy)ethanone
CID 169303341
(2-hydroxy-4-methoxyphenyl)-(2-hydroxyphenyl)methanone
CID 8569
1-[2-hydroxy-4-[(4-methoxyphenyl)methoxy]phenyl]-2-phenylethanone
CID 91871428
CID 175499515
CID 175499515
CID 172864174
CID 172864174
4-[2-(2,4-dihydroxyphenyl)-2-oxoethoxy]benzonitrile
CID 38900024
ethane;methyl 3-[2-(2,4-dihydroxyphenyl)-2-oxoethoxy]benzoate
CID 144606949
2-(4-chlorophenoxy)-1-(2-hydroxyphenyl)ethanone
CID 71616835
(2-hydroxy-4-methoxyphenyl)-phenylmethanone;(4-methoxyphenyl)-phenylmethanone
CID 159601745
1-[2-hydroxy-4-(3-phenoxypropoxy)phenyl]-2-phenylethanone
CID 54179065

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone?
The IUPAC name of 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone (CID 12541853) is 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone.
What is the SMILES notation for 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone?
The canonical SMILES for 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone is COc1ccc(C(=O)COc2ccccc2)c(O)c1.
What is the InChIKey of 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone?
The InChIKey is UBWQNOKFGMXMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O4/c1-18-12-7-8-13(14(16)9-12)15(17)10-19-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3.
What are the key properties of 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone?
1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone has a molecular weight of 258.27 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-4-methoxyphenyl)-2-phenoxyethanone is sourced from PubChem (CID 12541853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).