Cas no 117-56-6 (1,5-Naphthalenedisulfonicacid, 4-hydroxy-)

1,5-Naphthalenedisulfonicacid, 4-hydroxy- structure
117-56-6 structure
Product Name:1,5-Naphthalenedisulfonicacid, 4-hydroxy-
CAS No:117-56-6
MF:C10H8O7S2
MW:304.296320915222
CID:166583
PubChem ID:67023
Update Time:2025-04-19

1,5-Naphthalenedisulfonicacid, 4-hydroxy- Chemical and Physical Properties

Names and Identifiers

    • 1,5-Naphthalenedisulfonicacid, 4-hydroxy-
    • 4-hydroxynaphthalene-1,5-disulfonic acid
    • 4-hydroxynaphthalene-1,5-disulphonic acid
    • 1-Naphthol-4,8-disulfonic acid
    • Schoellkopf's acid
    • α-Naphtholdisulfonic acid S
    • 8-Hydroxy-1,5-naphthalenedisulfonic acid
    • 4-Hydroxy-1,5-naphthalenedisulfonic acid
    • .alpha.-Naphthol-4,8-disulfonic acid
    • L6O8AVH6FU
    • .alpha.-Naphtholdisulfonic acid S
    • UNII-L6O8AVH6FU
    • NSC-8629
    • 1-NAPHTHOL-4,8-DISULFONIC ACID [MI]
    • DTXSID30151655
    • NS00023791
    • 117-56-6
    • SCHEMBL2932464
    • Q27282785
    • EINECS 204-197-6
    • NSC8629
    • 1-hydroxynaphthalene-4,8-disulfonic acid
    • NSC 8629
    • Inchi: 1S/C10H8O7S2/c11-7-4-5-8(18(12,13)14)6-2-1-3-9(10(6)7)19(15,16)17/h1-5,11H,(H,12,13,14)(H,15,16,17)
    • InChI Key: XIQKALDENTUXBY-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=C2C(=CC=C(C2=1)O)S(=O)(=O)O)(=O)(=O)O

Computed Properties

  • Exact Mass: 303.97114
  • Monoisotopic Mass: 303.971144
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 527
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 146
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 0.3

Experimental Properties

  • Density: 1.816
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • Refractive Index: 1.725
  • PSA: 128.97

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