5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one

C17H14O5 — CID 15896568

IUPAC5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(OCCO)cc(O)c12
InChIInChI=1S/C17H14O5/c18-6-7-21-12-8-13(19)17-14(20)10-15(22-16(17)9-12)11-4-2-1-3-5-11/h1-5,8-10,18-19H,6-7H2
InChIKeyPREHZPITPQKPAT-UHFFFAOYSA-N
MW298.29 g/mol
LogP2.54
Rot. Bonds4

About 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one

5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one (PubChem CID 15896568) has the molecular formula C17H14O5 and a molecular weight of 298.29 g/mol. Its IUPAC name is 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one.

Molecular Properties

Compound Name5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one
PubChem CID15896568
Molecular FormulaC17H14O5
Molecular Weight298.29 g/mol
Exact Mass298.08
IUPAC Name5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(OCCO)cc(O)c12
InChIInChI=1S/C17H14O5/c18-6-7-21-12-8-13(19)17-14(20)10-15(22-16(17)9-12)11-4-2-1-3-5-11/h1-5,8-10,18-19H,6-7H2
InChIKeyPREHZPITPQKPAT-UHFFFAOYSA-N
XLogP2.54
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.29
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

7-(8-bromooctoxy)-5-hydroxy-2-phenylchromen-4-one
CID 172994912
8-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoctanoic acid
CID 172994915
7-[2-(benzylamino)ethoxy]-5-hydroxy-2-phenylchromen-4-one
CID 46898624
7-[(4-bromophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
CID 6029612
5-hydroxy-2-phenyl-7-(3-phenylprop-2-enoxy)chromen-4-one
CID 6802595
4-bromobutyl 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetate
CID 53486698
5-hydroxy-2-phenyl-7-(4-piperidin-4-ylbutoxy)chromen-4-one
CID 68755771
5-hydroxy-7-[2-(2-morpholin-4-ylethylamino)ethoxy]-2-phenylchromen-4-one
CID 134122328
7-hexoxy-2-(4-hexoxyphenyl)-5-hydroxychromen-4-one
CID 132568297
bis(5,7-dihydroxy-2-phenylchromen-4-one);sulfuric acid
CID 174670813
7-(4-bromo-2,4-dimethylpentan-2-yl)oxy-5-hydroxy-2-phenylchromen-4-one
CID 91144753
5-hydroxy-2-phenyl-7-[(1R,2R,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxychromen-4-one
CID 58212199

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one?
The IUPAC name of 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one (CID 15896568) is 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one.
What is the SMILES notation for 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one?
The canonical SMILES for 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one is O=c1cc(-c2ccccc2)oc2cc(OCCO)cc(O)c12.
What is the InChIKey of 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one?
The InChIKey is PREHZPITPQKPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O5/c18-6-7-21-12-8-13(19)17-14(20)10-15(22-16(17)9-12)11-4-2-1-3-5-11/h1-5,8-10,18-19H,6-7H2.
What are the key properties of 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one?
5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one has a molecular weight of 298.29 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-7-(2-hydroxyethoxy)-2-phenylchromen-4-one is sourced from PubChem (CID 15896568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).