7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one

C17H14O7 — CID 163010964

IUPAC7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one
SMILESCOc1c(Oc2ccc(O)cc2)oc2cc(O)cc(OC)c2c1=O
InChIInChI=1S/C17H14O7/c1-21-12-7-10(19)8-13-14(12)15(20)16(22-2)17(24-13)23-11-5-3-9(18)4-6-11/h3-8,18-19H,1-2H3
InChIKeyAVLYCVUJOWBIOL-UHFFFAOYSA-N
MW330.29 g/mol
LogP3.01
Rot. Bonds4

About 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one

7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one (PubChem CID 163010964) has the molecular formula C17H14O7 and a molecular weight of 330.29 g/mol. Its IUPAC name is 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one.

Molecular Properties

Compound Name7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one
PubChem CID163010964
Molecular FormulaC17H14O7
Molecular Weight330.29 g/mol
Exact Mass330.07
IUPAC Name7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one
SMILESCOc1c(Oc2ccc(O)cc2)oc2cc(O)cc(OC)c2c1=O
InChIInChI=1S/C17H14O7/c1-21-12-7-10(19)8-13-14(12)15(20)16(22-2)17(24-13)23-11-5-3-9(18)4-6-11/h3-8,18-19H,1-2H3
InChIKeyAVLYCVUJOWBIOL-UHFFFAOYSA-N
XLogP3.01
TPSA98.36 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.29
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-hydroxy-2-(4-hydroxy-3-methoxyphenoxy)-3,7-dimethoxy-6-methylchromen-4-one
CID 162872700
2-(4-hydroxyphenyl)-3,5,7-trimethoxychromen-4-one
CID 14414499
1,2,6-trihydroxy-8-methoxyxanthen-9-one
CID 123716536
magnesium bis(2-(2,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-4-oxochromen-3-olate)
CID 11585501
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one
CID 5280862
2-(3,4-dihydroxyphenoxy)-5,7-dihydroxy-3-methoxy-6,8-dimethylchromen-4-one
CID 132989525
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxychromen-4-one
CID 5380905
6-hydroxy-1,3,5,7-tetramethoxyxanthen-9-one
CID 102460794
7-hydroxy-1,2,3-trimethoxyxanthen-9-one
CID 5320290
7-hydroxy-3-(4-hydroxyphenyl)-2,6-dimethoxy-5-methylperoxychromen-4-one
CID 91587475
3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one
CID 169439551
3-fluoro-7-hydroxy-5-methoxy-4-methylchromen-2-one
CID 164597280

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one?
The IUPAC name of 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one (CID 163010964) is 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one.
What is the SMILES notation for 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one?
The canonical SMILES for 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one is COc1c(Oc2ccc(O)cc2)oc2cc(O)cc(OC)c2c1=O.
What is the InChIKey of 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one?
The InChIKey is AVLYCVUJOWBIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O7/c1-21-12-7-10(19)8-13-14(12)15(20)16(22-2)17(24-13)23-11-5-3-9(18)4-6-11/h3-8,18-19H,1-2H3.
What are the key properties of 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one?
7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one has a molecular weight of 330.29 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-2-(4-hydroxyphenoxy)-3,5-dimethoxychromen-4-one is sourced from PubChem (CID 163010964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).