Cas no 5873-20-1 (2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2))

2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2) structure
5873-20-1 structure
Product Name:2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2)
CAS No:5873-20-1
MF:C23H16N6Na2O8S2
MW:614.518083572388
CID:375809
PubChem ID:135755581
Update Time:2025-04-19

2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2) Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2)
    • disodium 7-[(aminocarbonyl)amino]-4-hydroxy-3-[[4-[(4-sulphonatophenyl)azo]phenyl]azo]naphthalene-2-sulphonate
    • disodium,(3E)-7-(carbamoylamino)-4-oxo-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonate
    • 2-Naphthalenesulfonic acid, 7-((aminocarbonyl)amino)-4-hydroxy-3-((4-((4-sulfophenyl)azo)phenyl)azo)-, disodium salt
    • disodium (3E)-7-(carbamoylamino)-4-oxo-3-(2-{4-[(E)-(4-sulfonatophenyl)diazenyl]phenyl}hydrazinylidene)-3,4-dihydronaphthalene-2-sulfonate
    • Disodium 7-((aminocarbonyl)amino)-4-hydroxy-3-((4-((4-sulphonatophenyl)azo)phenyl)azo)naphthalene-2-sulphonate
    • Dianil Fast Red 6BL
    • Disodium 7-[(aminocarbonyl)amino]-4-hydroxy-3-[[4-[(4-sulfonatophenyl)azo]phenyl]azo]naphthalene-2-sulfonate
    • DTXSID4031859
    • 5873-20-1
    • NS00046073
    • EINECS 227-530-7
    • Inchi: 1S/C23H18N6O8S2.2Na/c24-23(31)25-17-7-10-19-13(11-17)12-20(39(35,36)37)21(22(19)30)29-28-15-3-1-14(2-4-15)26-27-16-5-8-18(9-6-16)38(32,33)34;;/h1-12,30H,(H3,24,25,31)(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2/b27-26+,29-28+;;
    • InChI Key: UCIAVFMGTWNMHG-AESVWCPUSA-L
    • SMILES: S(C1C(=C(C2C=CC(=CC=2C=1)NC(N)=O)O)/N=N/C1C=CC(=CC=1)/N=N/C1C=CC(=CC=1)S(=O)(=O)[O-])(=O)(=O)[O-].[Na+].[Na+]

Computed Properties

  • Exact Mass: 614.02688
  • Monoisotopic Mass: 614.027
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 5
  • Complexity: 1210
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 66
  • XLogP3: nothing
  • Topological Polar Surface Area: 253A^2

Experimental Properties

  • PSA: 239.19

2-Naphthalenesulfonicacid,7-[(aminocarbonyl)amino]-4-hydroxy-3-[2-[4-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-,sodium salt (1:2) Related Literature

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