Xylene cyanol

C25H27N2NaO6S2CAS 2650-17-1538.61 g/mol

NHNSO−OOSOOHONa+
AlkeneImineSecondary amineSulfonic acid

Properties

Molecular formula
C25H27N2NaO6S2
Molar mass
538.61 g/mol
Exact mass
538.1208 Da
logP
4.32Crippen estimate
Polar surface area
133.1 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
7

Hazards

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

Identifiers

CAS number
2650-17-1
SMILES
CCN=C1C=CC(=C(c2ccc(NCC)c(C)c2)c2ccc(S([O-])(=O)=O)cc2S(=O)(=O)O)C=C1C.[Na+]
InChI

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

17 names · show all
  • 1,3-Benzenedisulfonic acid, 4-[[4-(ethylamino)-3-methylphenyl][4-(ethylimino)-3-methyl-2,5-cyclohexadien-1-ylidene]methyl]-, sodium salt (1:1)
  • C.I. Acid Blue 147, monosodium salt
  • Xylene cyanole FF
  • 1,3-Benzenedisulfonic acid, 4-[[4-(ethylamino)-3-methylphenyl][4-(ethylimino)-3-methyl-2,5-cyclohexadien-1-ylidene]methyl]-, monosodium salt
  • C.I. Acid blue 147
  • C.I. 42135
  • Acidine pure blue C extra
  • Cyanol extra
  • Erio glaucine FFX
  • Kiton pure blue FF
  • Merantine blue FF
  • Disulphine blue FFN 200
  • Xylene cyanole
  • Acid blue 147
  • Xylene blue FF
  • Albion xylene cyanol
  • Xylene cyanol FF

Work with Xylene cyanol

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere