2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol

C15H12O4 — CID 10286022

IUPAC2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol
SMILESCOc1cc(O)cc2cc(-c3ccc(O)cc3)oc12
InChIInChI=1S/C15H12O4/c1-18-14-8-12(17)6-10-7-13(19-15(10)14)9-2-4-11(16)5-3-9/h2-8,16-17H,1H3
InChIKeyKEWMBPCQWDVBAS-UHFFFAOYSA-N
MW256.26 g/mol
LogP3.52
Rot. Bonds2

About 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol

2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol (PubChem CID 10286022) has the molecular formula C15H12O4 and a molecular weight of 256.26 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol
PubChem CID10286022
Molecular FormulaC15H12O4
Molecular Weight256.26 g/mol
Exact Mass256.07
IUPAC Name2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol
SMILESCOc1cc(O)cc2cc(-c3ccc(O)cc3)oc12
InChIInChI=1S/C15H12O4/c1-18-14-8-12(17)6-10-7-13(19-15(10)14)9-2-4-11(16)5-3-9/h2-8,16-17H,1H3
InChIKeyKEWMBPCQWDVBAS-UHFFFAOYSA-N
XLogP3.52
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol?
The IUPAC name of 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol (CID 10286022) is 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol.
What is the SMILES notation for 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol?
The canonical SMILES for 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol is COc1cc(O)cc2cc(-c3ccc(O)cc3)oc12.
What is the InChIKey of 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol?
The InChIKey is KEWMBPCQWDVBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O4/c1-18-14-8-12(17)6-10-7-13(19-15(10)14)9-2-4-11(16)5-3-9/h2-8,16-17H,1H3.
What are the key properties of 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol?
2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol has a molecular weight of 256.26 g/mol, XLogP of 3.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-7-methoxy-1-benzofuran-5-ol is sourced from PubChem (CID 10286022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).