Cas no 71550-19-1 (2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1))

2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1) structure
71550-19-1 structure
Product Name:2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1)
CAS No:71550-19-1
MF:C22H17N2NaO5S
MW:444.43555521965
CID:577603
PubChem ID:44152334
Update Time:2025-04-19

2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1) Chemical and Physical Properties

Names and Identifiers

    • 2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1)
    • 1-Amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid sodium salt
    • sodium,1-amino-4-(2,5-dimethylanilino)-9,10-dioxoanthracene-2-sulfonate
    • 2-anthrac<wbr>
    • LogP
    • Sodium 1-<wbr>
    • 2-Anthracenesulfonicacid,1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-,sodiumsalt(1:1)
    • DTXSID90887908
    • 2-Anthracenesulfonic acid, 1-amino-4-((2,5-dimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, monosodium salt
    • 2-Anthracenesulfonic acid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, monosodium salt
    • 2-Anthracenesulfonic acid, 1-amino-4-((2,5-dimethylphenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
    • CHEMBL256689
    • 2-Anthracenesulfonic acid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodium salt (1:1)
    • 71550-19-1
    • Inchi： 1S/C22H18N2O5S.Na/c1-11-7-8-12(2)15(9-11)24-16-10-17(30(27,28)29)20(23)19-18(16)21(25)13-5-3-4-6-14(13)22(19)26;/h3-10,24H,23H2,1-2H3,(H,27,28,29);/q;+1/p-1
    • InChI Key： PAFAWYISTWGZAG-UHFFFAOYSA-M
    • SMILES： S(C1=CC(=C2C(C3C=CC=CC=3C(C2=C1N)=O)=O)NC1C=C(C)C=CC=1C)(=O)(=O)[O-].[Na+]

Computed Properties

  • Exact Mass: 444.07571
  • Monoisotopic Mass: 444.076
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 3
  • Complexity: 800
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 138A^2

Experimental Properties

  • PSA: 129.39

2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1) Related Literature

71550-19-1 (2-Anthracenesulfonicacid, 1-amino-4-[(2,5-dimethylphenyl)amino]-9,10-dihydro-9,10-dioxo-, sodiumsalt (1:1)) Related Products

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