Chemical Compound

Acid blue 100

CAS Registry Number 5863-47-8
Acid blue 100 chemical structure
Primary Record

Acid blue 100

In stock
3,391 g
Purity
98.7 %
CAS
5863-47-8

Compound Identifiers & Properties

CAS
5863-47-8
PubChem CID
165364
SMILES
CCCCN(CCS(=O)(=O)[O-])C1=CC=C(C=C1)C(=C2C=CC(=[N+](CCCC)CCS(=O)(=O)[O-])C=C2)C3=CC=C(C=C3)NC4=CC=C(C=C4)OCC.[Na+]
Canonical SMILES
CCCCN(CCS(=O)(=O)[O-])c1ccc(C(=C2C=CC(=[N+](CCCC)CCS(=O)(=O)[O-])C=C2)c2ccc(Nc3ccc(OCC)cc3)cc2)cc1.[Na+]

Names & Synonyms

  • Acid blue 100
  • C.I. Acid Blue 100
  • AC1Q1VJI
  • RefChem:430832
  • AC1L4WK9
  • C39H48N3O7S2.Na
  • C39H49N3O7S2.Na
  • SCHEMBL29433950
  • EINECS 227-512-9
  • DTXSID80974174
  • NETSNTQRMHVIEK-UHFFFAOYSA-M
  • 5863-47-8
  • AR-1L4559
  • CID165364
  • C39-H49-N3-O7-S2.Na
  • C.I. Acid Blue 100, monosodium salt
  • R404
  • NS00122117
  • 1-Butanaminium, N-(4-((4-(butyl(2-sulfoethyl)amino)phenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-(2-sulfoethyl)-, inner salt, sodium salt (1:1)
  • Hydrogen N-[4-[[4-[butyl(2-sulphonatoethyl)amino]phenyl][4-[(4-ethoxyphenyl)amino]phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]-N-(2-sulphonatoethyl)butylammonium, monosodium salt
  • sodium;2-[N-butyl-4-[[4-[butyl(2-sulfonatoethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-[4-(4-ethoxyanilino)phenyl]methyl]anilino]ethanesulfonate
  • 1-Butanaminium, N-(4-((4-(butyl(2-sulfoethyl)amino)phenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-(2-sulfoethyl)-, inner salt, monosodium salt
  • sodium 2-{butyl[(1z,4z)-4-({4-[butyl(2-sulfonatoethyl)amino]phenyl}{4-[(4-ethoxyphenyl)amino]phenyl}methylidene)cyclohexa-2,5-dien-1-ylidene]ammonio}ethanesulfonate
  • 1-Butanaminium, N-[4-[[4-[butyl(2-sulfoethyl)amino]phenyl][4-[(4-ethoxyphenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-(2-sulfoethyl)-, hydroxide, inner salt, monosodium salt
  • 1-Butanaminium, N-[4-[[4-[butyl(2-sulfoethyl)amino]phenyl][4-[(4-ethoxyphenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-(2-sulfoethyl)-, inner salt, monosodium salt
  • 1-Butanaminium, N-[4-[[4-[butyl(2-sulfoethyl)amino]phenyl][4-[(4-ethoxyphenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-(2-sulfoethyl)-, inner salt, sodium salt (1:1)
  • 6513-26-4
  • Hydrogen N-(4-((4-(butyl(2-sulphonatoethyl)amino)phenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)-N-(2-sulphonatoethyl)butylammonium, monosodium salt
  • hydrogenN-[4-[[4-[butyl amino]phenyl][4-[ amino]phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]-N- butylammonium,monosodiumsalt
  • sodium 2-[N-butyl-4-[[4-[butyl(2-sulfonatoethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-[4-(4-ethoxyanilino)phenyl]methyl]anilino]ethanesulfonate
  • Sodium 2-{butyl[(1Z,4Z)-4-({4-[butyl(2-sulfonatoethyl)amino]phenyl}[4-(4-ethoxyanilino)phenyl]methylidene)cyclohexa-2,5-dien-1-ylidene]azaniumyl}ethane-1-sulfonate
  • Sodium 2-{butyl[4-({4-[butyl(2-sulfonatoethyl)amino]phenyl}[4-(4-ethoxyanilino)phenyl]methylidene)cyclohexa-2,5-dien-1-ylidene]azaniumyl}ethane-1-sulfonate