chempirical

1,4-Naphthalenediol

C10H8O2CAS 571-60-8160.17 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
123 °C
logP
2.25Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
571-60-8
SMILES
Oc1ccc(O)c2ccccc12
InChIKey
PCILLCXFKWDRMK-UHFFFAOYSA-N
InChI
InChI=1S/C10H8O2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,11-12H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • Naphthohydroquinone
  • 1,4-Dihydroxynaphthalene
  • Hydronaphthoquinone
  • 1,4-Naphthohydroquinone
  • α-Naphthoquinhydrone
  • 1,4-Naphthoquinol

Work with 1,4-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

1,5-Dihydroxynaphthalene83-56-775 % similar 4-Chloro-1-naphthol604-44-467 % similar 1-Naphthol90-15-363 % similar 4-Amino-1-naphthol hydrochloride5959-56-858 % similar 4-Methoxy-1-naphthol84-85-558 % similar 1,4,9,10-Anthracenetetrol476-60-857 % similar Catechol120-80-956 % similar (+)-Binol18531-94-755 % 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 1,2-Dihydroxynaphthalene574-00-5 1,7-Dihydroxynaphthalene575-38-2

Elsewhere

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