chempirical

Naphthazarin

C10H6O4CAS 475-38-7190.15 g/mol

Open in Covalent MOL file
OOOHHO
AlkeneKetonePhenol

Properties

Molecular formula
C10H6O4
Molar mass
190.15 g/mol
Exact mass
190.0266 Da
Melting point
232 °C
logP
1.03Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
0

Identifiers

CAS number
475-38-7
SMILES
O=C1C=CC(=O)c2c(O)ccc(O)c21
InChIKey
RQNVIKXOOKXAJQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H

Weigh it out

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

Names and synonyms

10 names
  • 1,4-Naphthalenedione, 5,8-dihydroxy-
  • 1,4-Naphthoquinone, 5,8-dihydroxy-
  • 5,8-Dihydroxy-1,4-naphthalenedione
  • 5,8-Dihydroxy-1,4-naphthosemiquinone
  • 5,8-Dihydroxynaphthoquinone
  • Naphthazarine
  • Naphthazarone
  • 5,8-Dihydroxy-1,4-naphthoquinone
  • NSC 26647
  • NSC 344555

Work with Naphthazarin

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

Juglone481-39-064 % similar 1,4,5,8-Tetrahydroxy-9,10-anthracenedione81-60-754 % similar 2′,4,4′,6′-Tetrahydroxychalcone73692-50-947 % similar 1,5-Diamino-4,8-dihydroxy-9,10-anthracenedione145-49-342 % similar Deoxyshikonin43043-74-941 % similar 2,6-Dihydroxybenzoic acid303-07-141 % similar 2′-Hydroxychalcone1214-47-741 % similar 1,4-Diphenyl-2-butene-1,4-dione4070-75-141 % similar

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

Same formula

Alpha-furil492-94-4 4-Oxo-4H-1-benzopyran-2-carboxylic acid4940-39-0 Coumarin-3-carboxylic acid531-81-7

Elsewhere

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