chempirical

Benzo(C)cinnoline

C12H8N2CAS 230-17-1180.21 g/mol

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Properties

Molecular formula
C12H8N2
Molar mass
180.21 g/mol
Exact mass
180.0687 Da
Density
1.307 g/mL (at 20 °C)
Melting point
158 °C
logP
2.78Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
230-17-1
SMILES
c1ccc2c(c1)nnc1ccccc12
InChIKey
SWJXWSAKHXBQSY-UHFFFAOYSA-N
InChI
InChI=1S/C12H8N2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)14-13-11/h1-8H

Weigh it out

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Names and synonyms

10 names
  • Benzo[c]cinnoline
  • 9,10-Diazaphenanthrene
  • Diphenylenazone
  • 3,4-Benzocinnoline
  • Phenazone (three-ring system)
  • 5,6-Phenanthroline
  • 2,2′-Azobiphenyl
  • Phenazone
  • 5,6-Diazaphenanthrene
  • NSC 86935

Work with Benzo(C)cinnoline

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

1,2,3-Benzotriazin-4(3H)-one90-16-450 % similar Phenanthridine229-87-848 % similar Triphenylene217-59-447 % similar 6(5H)-Phenanthridinone1015-89-046 % similar 9-Chloroacridine1207-69-843 % similar 9-Methylacridine611-64-343 % similar 2,3-Dihydro-1,4-phthalazinedione1445-69-843 % similar 3,4-Dihydro-3-hydroxy-4-oxo-1,2,3-benzotriazine28230-32-243 % similar

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

Same formula

1,7-Phenanthroline230-46-6 1,10-Phenanthroline66-71-7 Phenazine92-82-0

Elsewhere

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