5-hydroxy-2-(2-methoxyphenyl)chromen-4-one

C16H12O4 — CID 688677

IUPAC5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
SMILESCOc1ccccc1-c1cc(=O)c2c(O)cccc2o1
InChIInChI=1S/C16H12O4/c1-19-13-7-3-2-5-10(13)15-9-12(18)16-11(17)6-4-8-14(16)20-15/h2-9,17H,1H3
InChIKeyOHYPQURAHPKQEA-UHFFFAOYSA-N
MW268.27 g/mol
LogP3.17
Rot. Bonds2

About 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one

5-hydroxy-2-(2-methoxyphenyl)chromen-4-one (PubChem CID 688677) has the molecular formula C16H12O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one.

Molecular Properties

Compound Name5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
PubChem CID688677
Molecular FormulaC16H12O4
Molecular Weight268.27 g/mol
Exact Mass268.07
IUPAC Name5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
SMILESCOc1ccccc1-c1cc(=O)c2c(O)cccc2o1
InChIInChI=1S/C16H12O4/c1-19-13-7-3-2-5-10(13)15-9-12(18)16-11(17)6-4-8-14(16)20-15/h2-9,17H,1H3
InChIKeyOHYPQURAHPKQEA-UHFFFAOYSA-N
XLogP3.17
TPSA59.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
CID 100995351
5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one
CID 12794885
5-hydroxy-2-(2-hydroxyphenyl)-7-methoxychromen-4-one
CID 15559079
2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
CID 13190885
6-methoxy-2-(2-methoxyphenyl)chromen-4-one
CID 676288
CID 172853606
CID 172853606
2-(2,3-dimethoxyphenyl)-7-hydroxychromen-4-one
CID 127031650
5-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
CID 18761939
methyl 4-(5-hydroxy-4-oxochromen-2-yl)benzoate
CID 73350464
(2S,3S,4S,5R,6S)-6-[5,6-dihydroxy-2-(2-methoxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
CID 11762528
5-hydroxy-7-methoxy-2-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
CID 6018900
5-methoxy-2-(2-methoxynaphthalen-1-yl)chromen-4-one
CID 142743418

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one?
The IUPAC name of 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one (CID 688677) is 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one.
What is the SMILES notation for 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one?
The canonical SMILES for 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one is COc1ccccc1-c1cc(=O)c2c(O)cccc2o1.
What is the InChIKey of 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one?
The InChIKey is OHYPQURAHPKQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12O4/c1-19-13-7-3-2-5-10(13)15-9-12(18)16-11(17)6-4-8-14(16)20-15/h2-9,17H,1H3.
What are the key properties of 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one?
5-hydroxy-2-(2-methoxyphenyl)chromen-4-one has a molecular weight of 268.27 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-(2-methoxyphenyl)chromen-4-one is sourced from PubChem (CID 688677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).