Janus green B

C30H31ClN6CAS 2869-83-2511.07 g/mol

Open in Covalent MOL file
NNN+NNNCl−
Tertiary amine

Properties

Molecular formula
C30H31ClN6
Molar mass
511.07 g/mol
Exact mass
510.2299 Da
logP
2.94Crippen estimate
Polar surface area
50.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Hazards

Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
2869-83-2
SMILES
CCN(CC)c1ccc2nc3ccc(=[N+]=Nc4ccc(N(C)C)cc4)cc-3n(-c3ccccc3)c2c1.[Cl-]
InChIKey
XXACTDWGHQXLGW-UHFFFAOYSA-M
InChI
InChI=1S/C30H31N6.ClH/c1-5-35(6-2)26-17-19-28-30(21-26)36(25-10-8-7-9-11-25)29-20-23(14-18-27(29)31-28)33-32-22-12-15-24(16-13-22)34(3)4;/h7-21H,5-6H2,1-4H3;1H/q+1;/p-1

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Names and synonyms

9 names
  • Phenazinium, 3-(diethylamino)-7-[2-[4-(dimethylamino)phenyl]diazenyl]-5-phenyl-, chloride (1:1)
  • Phenazinium, 3-(diethylamino)-7-[[p-(dimethylamino)phenyl]azo]-5-phenyl-, chloride
  • 3-Diethylamino-7-(p-dimethylaminophenylazo)-5-phenylphenazinium chloride
  • Phenazinium, 3-(diethylamino)-7-[[4-(dimethylamino)phenyl]azo]-5-phenyl-, chloride
  • C.I. 11050
  • Janus green V
  • Union green B
  • JGB
  • L 26

Work with Janus green B

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

Methylene violet 3RAX4569-86-256 % similar Solvent yellow 562481-94-931 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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