CHEBI:21184 - Janus Green B chloride

ChEBI IDCHEBI:21184
ChEBI NameJanus Green B chloride
Stars
Last Modified19 November 2008
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FormulaC30H31N6.Cl
Net Charge0
Average Mass511.073
Monoisotopic Mass510.22987
SMILESCCN(CC)c1ccc2nc3ccc(/N=N/c4ccc(N(C)C)cc4)cc3[n+](-c3ccccc3)c2c1.[Cl-]
InChIInChI=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
InChIKeyXXACTDWGHQXLGW-UHFFFAOYSA-M
Roles Classification
ChEBI Ontology
Outgoing Relation(s)
Janus Green B chloride (CHEBI:21184) has part Janus Green B cation (CHEBI:51070)
Janus Green B chloride (CHEBI:21184) has role dye (CHEBI:37958)
Janus Green B chloride (CHEBI:21184) is a organic chloride salt (CHEBI:36094)
IUPAC Name 
3-(diethylamino)-7-{(E)-[4-(dimethylamino)phenyl]diazenyl}-5-phenylphenazin-5-ium chloride
Synonyms  Source
Janus Green VChemIDplus
3-(diethylamino)-7-((p-(dimethylamino)phenyl)azo)-5-phenylphenazinium chlorideChemIDplus
3-(diethylamino)-7-((4-(dimethylamino)phenyl)azo)-5-phenylphenazinium chlorideChemIDplus
Janus Green BChemIDplus
Manual XrefsDatabases
US2882209Patent
Registry NumbersSources
Beilstein:9748061Beilstein
CAS:2869-83-2ChemIDplus