4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol

C15H12O5 — CID 10265236

IUPAC4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol
SMILESCOc1cc2oc(-c3ccc(O)cc3O)cc2cc1O
InChIInChI=1S/C15H12O5/c1-19-15-7-13-8(4-12(15)18)5-14(20-13)10-3-2-9(16)6-11(10)17/h2-7,16-18H,1H3
InChIKeyKJOUKFLQGCLIOG-UHFFFAOYSA-N
MW272.26 g/mol
LogP3.23
Rot. Bonds2

About 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol

4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol (PubChem CID 10265236) has the molecular formula C15H12O5 and a molecular weight of 272.26 g/mol. Its IUPAC name is 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol.

Molecular Properties

Compound Name4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol
PubChem CID10265236
Molecular FormulaC15H12O5
Molecular Weight272.26 g/mol
Exact Mass272.07
IUPAC Name4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol
SMILESCOc1cc2oc(-c3ccc(O)cc3O)cc2cc1O
InChIInChI=1S/C15H12O5/c1-19-15-7-13-8(4-12(15)18)5-14(20-13)10-3-2-9(16)6-11(10)17/h2-7,16-18H,1H3
InChIKeyKJOUKFLQGCLIOG-UHFFFAOYSA-N
XLogP3.23
TPSA83.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 53.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

CID 5280343
CID 5280343
CID 68077
CID 68077
CID 5281612
CID 5281612
CID 72281
CID 72281
CID 5280445
CID 5280445
CID 68079
CID 68079
CID 3828
CID 3828
CID 5281605
CID 5281605
CID 5317750
CID 5317750
CID 5281614
CID 5281614
CID 5281650
CID 5281650
CID 5281654
CID 5281654

Frequently Asked Questions

What is the IUPAC name of 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol?
The IUPAC name of 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol (CID 10265236) is 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol.
What is the SMILES notation for 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol?
The canonical SMILES for 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol is COc1cc2oc(-c3ccc(O)cc3O)cc2cc1O.
What is the InChIKey of 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol?
The InChIKey is KJOUKFLQGCLIOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O5/c1-19-15-7-13-8(4-12(15)18)5-14(20-13)10-3-2-9(16)6-11(10)17/h2-7,16-18H,1H3.
What are the key properties of 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol?
4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol has a molecular weight of 272.26 g/mol, XLogP of 3.23, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxy-6-methoxy-1-benzofuran-2-yl)benzene-1,3-diol is sourced from PubChem (CID 10265236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).