benzo[f][1]benzofuran-3-ol

C12H8O2 — CID 54429171

IUPACbenzo[f][1]benzofuran-3-ol
SMILESOc1coc2cc3ccccc3cc12
InChIInChI=1S/C12H8O2/c13-11-7-14-12-6-9-4-2-1-3-8(9)5-10(11)12/h1-7,13H
InChIKeyWGGPXAFGIQCAGV-UHFFFAOYSA-N
MW184.19 g/mol
LogP3.29
Rot. Bonds

About benzo[f][1]benzofuran-3-ol

benzo[f][1]benzofuran-3-ol (PubChem CID 54429171) has the molecular formula C12H8O2 and a molecular weight of 184.19 g/mol. Its IUPAC name is benzo[f][1]benzofuran-3-ol.

Molecular Properties

Compound Namebenzo[f][1]benzofuran-3-ol
PubChem CID54429171
Molecular FormulaC12H8O2
Molecular Weight184.19 g/mol
Exact Mass184.05
IUPAC Namebenzo[f][1]benzofuran-3-ol
SMILESOc1coc2cc3ccccc3cc12
InChIInChI=1S/C12H8O2/c13-11-7-14-12-6-9-4-2-1-3-8(9)5-10(11)12/h1-7,13H
InChIKeyWGGPXAFGIQCAGV-UHFFFAOYSA-N
XLogP3.29
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzo[f][1]benzofuran-3-ol?
The IUPAC name of benzo[f][1]benzofuran-3-ol (CID 54429171) is benzo[f][1]benzofuran-3-ol.
What is the SMILES notation for benzo[f][1]benzofuran-3-ol?
The canonical SMILES for benzo[f][1]benzofuran-3-ol is Oc1coc2cc3ccccc3cc12.
What is the InChIKey of benzo[f][1]benzofuran-3-ol?
The InChIKey is WGGPXAFGIQCAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O2/c13-11-7-14-12-6-9-4-2-1-3-8(9)5-10(11)12/h1-7,13H.
What are the key properties of benzo[f][1]benzofuran-3-ol?
benzo[f][1]benzofuran-3-ol has a molecular weight of 184.19 g/mol, XLogP of 3.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[f][1]benzofuran-3-ol is sourced from PubChem (CID 54429171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).