5-(1-benzofuran-2-yl)benzene-1,3-diol

C14H10O3 — CID 641363

IUPAC5-(1-benzofuran-2-yl)benzene-1,3-diol
SMILESOc1cc(O)cc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C14H10O3/c15-11-5-10(6-12(16)8-11)14-7-9-3-1-2-4-13(9)17-14/h1-8,15-16H
InChIKeyZZTDCNYCFAJAMX-UHFFFAOYSA-N
MW226.23 g/mol
LogP3.51
Rot. Bonds1

About 5-(1-benzofuran-2-yl)benzene-1,3-diol

5-(1-benzofuran-2-yl)benzene-1,3-diol (PubChem CID 641363) has the molecular formula C14H10O3 and a molecular weight of 226.23 g/mol. Its IUPAC name is 5-(1-benzofuran-2-yl)benzene-1,3-diol.

Molecular Properties

Compound Name5-(1-benzofuran-2-yl)benzene-1,3-diol
PubChem CID641363
Molecular FormulaC14H10O3
Molecular Weight226.23 g/mol
Exact Mass226.06
IUPAC Name5-(1-benzofuran-2-yl)benzene-1,3-diol
SMILESOc1cc(O)cc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C14H10O3/c15-11-5-10(6-12(16)8-11)14-7-9-3-1-2-4-13(9)17-14/h1-8,15-16H
InChIKeyZZTDCNYCFAJAMX-UHFFFAOYSA-N
XLogP3.51
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(1-benzofuran-2-yl)benzene-1,3-diol?
The IUPAC name of 5-(1-benzofuran-2-yl)benzene-1,3-diol (CID 641363) is 5-(1-benzofuran-2-yl)benzene-1,3-diol.
What is the SMILES notation for 5-(1-benzofuran-2-yl)benzene-1,3-diol?
The canonical SMILES for 5-(1-benzofuran-2-yl)benzene-1,3-diol is Oc1cc(O)cc(-c2cc3ccccc3o2)c1.
What is the InChIKey of 5-(1-benzofuran-2-yl)benzene-1,3-diol?
The InChIKey is ZZTDCNYCFAJAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O3/c15-11-5-10(6-12(16)8-11)14-7-9-3-1-2-4-13(9)17-14/h1-8,15-16H.
What are the key properties of 5-(1-benzofuran-2-yl)benzene-1,3-diol?
5-(1-benzofuran-2-yl)benzene-1,3-diol has a molecular weight of 226.23 g/mol, XLogP of 3.51, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzofuran-2-yl)benzene-1,3-diol is sourced from PubChem (CID 641363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).