chempirical

2-Dibenzofuranol

C12H8O2CAS 86-77-1184.19 g/mol

Open in Covalent MOL file
HOO
Phenol

Properties

Molecular formula
C12H8O2
Molar mass
184.19 g/mol
Exact mass
184.0524 Da
Melting point
136 °C
Boiling point
348 °C (at 758 Torr)
logP
3.29Crippen estimate
Polar surface area
33.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
86-77-1
SMILES
Oc1ccc2oc3ccccc3c2c1
InChIKey
HGIDRHWWNZRUEP-UHFFFAOYSA-N
InChI
InChI=1S/C12H8O2/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7,13H

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Names and synonyms

5 names
  • NSC 10863
  • 3-Hydroxybiphenylene oxide
  • 2-Hydroxydibenzofuran
  • Dibenzo[b,d]furan-2-ol
  • 2-Dibenzofuranol, 4a,9b-dihydro-

Work with 2-Dibenzofuranol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Bromodibenzofuran86-76-060 % similar Dibenzofuran132-64-958 % similar Urolithin B1139-83-951 % similar 6-Hydroxyflavone6665-83-450 % similar 2-Dibenzofuransulfonic acid83863-63-250 % similar 6-Hydroxy-4-methylcoumarin2373-31-146 % similar Urolithin A1143-70-046 % similar 3-Dibenzofuranamine4106-66-545 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook