Cas no 71411-80-8 (1,3-Naphthalenedisulfonicacid, 7-amino-, sodium salt (1:?))

1,3-Naphthalenedisulfonicacid, 7-amino-, sodium salt (1:?) structure
71411-80-8 structure
Product Name:1,3-Naphthalenedisulfonicacid, 7-amino-, sodium salt (1:?)
CAS No:71411-80-8
MF:C10H8NNaO6S2
MW:325.293391227722
CID:548250
PubChem ID:23686649
Update Time:2025-04-19

1,3-Naphthalenedisulfonicacid, 7-amino-, sodium salt (1:?) Chemical and Physical Properties

Names and Identifiers

    • 1,3-Naphthalenedisulfonicacid, 7-amino-, sodium salt (1:?)
    • (5S,6S)-6-hydroxy-2,2,7,7-tetramethyl-5-(1,2,4-triazol-1-yl)octan-3-one
    • 7-aminonaphthalene-1,3-disulphonic acid, sodium salt
    • sodium 6-amino-4-sulfonaphthalene-2-sulfonate
    • sodium 6-azanyl-4-sulfo-naphthalene-2-sulfonate
    • EINECS 212-670-3
    • 7-AMINO-1,3-NAPHTHALENEDISULFONIC ACID MONOSODIUM SALT
    • DTXSID10991753
    • sodium 6-amino-4-sulfo-2-naphthalenesulfonate
    • EINECS 275-385-3
    • 842-16-0
    • SCHEMBL8008837
    • 71411-80-8
    • A840740
    • Sodium hydrogen 7-aminonaphthalene-1,3-disulphonate
    • Inchi: 1S/C10H9NO6S2.Na/c11-7-2-1-6-3-8(18(12,13)14)5-10(9(6)4-7)19(15,16)17;/h1-5H,11H2,(H,12,13,14)(H,15,16,17);/q;+1/p-1
    • InChI Key: WXLAGQSCYQGDAR-UHFFFAOYSA-M
    • SMILES: S(C1C=C(C=C2C=CC(=CC=12)N)S(=O)(=O)[O-])(=O)(=O)O.[Na+]

Computed Properties

  • Exact Mass: 346.951
  • Monoisotopic Mass: 346.951
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 318
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 2.1
  • Topological Polar Surface Area: 157A^2
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