chempirical

Acid blue 40

C22H16N3NaO6SCAS 6424-85-7473.43 g/mol

Open in Covalent MOL file
OHNNHSO−OONH2OONa+
KetonePrimary amineSecondary amineSulfonic acid

Properties

Molecular formula
C22H16N3NaO6S
Molar mass
473.43 g/mol
Exact mass
473.0658 Da
Melting point
above 300 °C
logP
3.26Crippen estimate
Polar surface area
159.2 Ų
H-bond donors / acceptors
4 / 7
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
6424-85-7
SMILES
CC(=O)Nc1ccc(Nc2cc(S([O-])(=O)=O)c(N)c3C(=O)c4ccccc4C(=O)c23)cc1.[Na+]

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

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

Names and synonyms

93 names · show all
  • 2-Anthracenesulfonic acid, 4-[[4-(acetylamino)phenyl]amino]-1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
  • 2-Anthracenesulfonic acid, 4-(p-acetamidoanilino)-1-amino-9,10-dihydro-9,10-dioxo-, monosodium salt
  • 2-Anthracenesulfonic acid, 4-[[4-(acetylamino)phenyl]amino]-1-amino-9,10-dihydro-9,10-dioxo-, monosodium salt
  • 2-Anthracenesulfonic acid, 4-(p-acetamidoanilino)-1-amino-9,10-dihydro-9,10-dioxo-, sodium salt
  • C.I. 62125
  • Acid alizarine blue A 2G
  • Acid alizarine sapphire 2JL
  • Acidine fast blue ADG
  • Ahcoquinone blue A 2G
  • Alizarine blue A 2G
  • Alizarine blue AGG
  • Alizarine direct blue AGG
  • Alizarine direct blue AGG-CF
  • Alizarine light blue 2G
  • Alizarine light blue 2GH
  • Alizarine light blue 2GL
  • Anthralan blue G
  • Anthraquinone blue 2GAN
  • Aquamine blue GL
  • Calcocid alizarine blue A 2G
  • C.I. Acid blue 40
  • Curol blue an
  • Erio anthracene brilliant blue 2GL
  • Erio fast blue 2GL
  • Erionyl blue E 2GL
  • Fenalan blue G
  • Kayacyl blue AGG
  • Kayaku alizarine blue AGG
  • Kiton fast blue 2GL
  • Lanaperl blue G
  • Merpacyl blue 2GA
  • Mitsui alizarine direct blue AGG
  • Nylomine acid blue B 3G
  • Propolan blue 2GX
  • Solanol blue G
  • Solway blue 2G
  • Suminol fast blue AGG
  • Suminol levelling blue AGG
  • Superian blue 2G
  • Unitertracid blue GGL
  • Unitertracid fast blue GGL
  • 4-(p-Acetamidoanilino)-1-amino-2-anthraquinonesulfonic acid monosodium salt
  • Sodium 1-amino-4-(4-acetamidoanilino)anthraquinone-2-sulfonate
  • C.I. Acid Blue 40 sodium salt
  • Alizarine direct blue A 2G
  • Telon light blue GGL
  • Acid fast blue 2G
  • Acid alizarine blue 2G
  • Alizarine azurol A 2G
  • Egacid blue A 2G
  • Kayanol blue N 2G
  • Orbacid fast blue AGL
  • Nylosan blue E 2GL
  • Telon blue GGLL
  • Aminyl blue E 2GL
  • Acid brilliant blue 2GB
  • Acid blue 2GL
  • Vicoacid blue 40
  • Acid blue 2G
  • Acid blue E 2G
  • Rifa acid fast blue E-AGG
  • Dycosacid brilliant blue 2GB
  • Covanyl blue KGL
  • Acid blue AGG
  • Triacid light blue 2G
  • Superlan blue 2G
  • Relon blue 2G
  • Selmacid blue E 2GL
  • Kenamide blue G 3G
  • Apollo nylon fast blue A 2G
  • Dyacid blue 2G
  • Daedo acid blue 3AGG
  • Acid blue A 2G243
  • Conacid blue DO
  • Acid blue A 2G
  • Concorde acid blue N 2G
  • Colocid blue E 2G
  • Everacid blue A 2G
  • Suracid blue 2G
  • Everacid levelling blue A 2G
  • Elbenyl blue B 2G
  • Lerui acid blue E 2GL
  • Daedo acid blue C-AGG
  • Fabracid blue A 2G
  • Eniacid light blue E 2GA
  • Multacid blue 2G
  • Naphthazine blue KGL
  • Sellanyl blue E 2GL
  • Best acid blue N 2G
  • Eniamide blue E 2GA
  • Dinacid alizarine blue AZG
  • Nylosan blue E 2GL 200
  • Weak acid blue 2G

Work with Acid blue 40

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

Acid blue 256408-78-280 % similar Acid blue 624368-56-360 % similar Sodium 1-amino-4-bromoanthraquinone-2-sulfonate6258-06-658 % similar Remazol brilliant blue R2580-78-158 % similar Acid blue 26062168-86-957 % similar C.I. Mordant black 131324-21-655 % similar Acid green 254403-90-151 % similar Acid blue 804474-24-248 % similar

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

Elsewhere

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