chempirical

2,7-Naphthalenediol

C10H8O2CAS 582-17-2160.17 g/mol

Open in Covalent MOL file
HOOH
Phenol

Properties

Molecular formula
C10H8O2
Molar mass
160.17 g/mol
Exact mass
160.0524 Da
Melting point
193 °C
logP
2.25Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
582-17-2
SMILES
Oc1ccc2ccc(O)cc2c1
InChIKey
DFQICHCWIIJABH-UHFFFAOYSA-N
InChI
InChI=1S/C10H8O2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,11-12H

Weigh it out

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Names and synonyms

6 names
  • 2,7-Dihydroxynaphthalene
  • C.I. 76645
  • NSC 407541
  • 2,7-Naphthohydroquinone
  • 7-Hydroxy-2-naphthol
  • D 0594

Work with 2,7-Naphthalenediol

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

2,6-Dihydroxynaphthalene581-43-181 % similar 2-Naphthol135-19-374 % similar 2-Bromo-7-hydroxynaphthalene116230-30-971 % similar 7-Isoquinolinol7651-83-458 % similar 6,6′-Dithiobis[2-naphthalenol]6088-51-357 % similar B-(6-Hydroxy-2-naphthalenyl)boronic acid173194-95-154 % similar 6-Isoquinolinol7651-82-352 % similar Hydroquinone123-31-950 % similar

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

Same formula

3-Ethynyl-4-methyl-benzoic acid1001203-03-7 1,3-Dihydroxynaphthalene132-86-5 2-Acetylbenzofuran1646-26-0 7-Methylcoumarin2445-83-2 2H-1-Benzopyran-3-carboxaldehyde51593-69-2 1,8-Dihydroxynaphthalene569-42-6 1,4-Naphthalenediol571-60-8 1,2-Dihydroxynaphthalene574-00-5

Elsewhere

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