Cas no 73413-79-3 (Camphorquinone-10-sulfonic acid)

Camphorquinone-10-sulfonic acid structure
73413-79-3 structure
Product Name:Camphorquinone-10-sulfonic acid
CAS No:73413-79-3
MF:C10H14O5S
MW:264.29544
CID:571729
PubChem ID:189789
Update Time:2024-10-27

Camphorquinone-10-sulfonic acid Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[2.2.1]heptane-1-methanesulfonicacid, 7,7-dimethyl-2,3-dioxo-, (1S,4S)-
    • Camphorquinone-10-sulfonic Acid Hydrate
    • CAMPHORQUINONE-10-SULFONIC ACID, HYDRATE TECHNICAL GRADE
    • (1S,4S)-7,7-diMethyl-2,3-dioxobicyclo[2.2.1]heptane-1-Methanesulfonic Acid
    • CAMPHORQUINONE-1-SULFONIC ACID,HYDRATE
    • CQS-OH
    • [(1S,4S)-7,7-Dimethyl-2,3-dioxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid
    • Bicyclo(2.2.1)heptane-1-methanesulfonic acid, 7,7-dimethyl-2,3-dioxo-, (1S)-
    • (7,7-Dimethyl-2,3-dioxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid
    • AKOS027382282
    • 73413-79-3
    • DTXSID60994133
    • 7,7-Dimethylbicyclo(2.2.1)heptane-2,3-dione-1-methanesulfonic acid
    • ((1S,4S)-7,7-Dimethyl-2,3-dioxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid
    • Camphorquinone-10-sulfonic acid
    • Inchi: InChI=1S/C10H14O5S/c1-9(2)6-3-4-10(9,5-16(13,14)15)8(12)7(6)11/h6H,3-5H2,1-2H3,(H,13,14,15)
    • InChI Key: VQHWAOZYKVGMQX-UHFFFAOYSA-N
    • SMILES: CC1(C2CCC1(C(=O)C2=O)CS(=O)(=O)O)C

Computed Properties

  • Exact Mass: 264.06700
  • Monoisotopic Mass: 246.056
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 470
  • 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
  • XLogP3: _0.1
  • Topological Polar Surface Area: 96.9A^2

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Melting Point: 155-157°C
  • Refractive Index: 1.554
  • PSA: 106.12000
  • LogP: 1.46510
  • Vapor Pressure: NO data available

Camphorquinone-10-sulfonic acid Security Information

  • Signal Word:warning
  • Hazard Statement: H303+H313+H333
  • Warning Statement: P264+P280+P305+P351+P338+P337+P313
  • Hazardous Material transportation number:UN 3261 8/PG 3
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: S26; S36/37/39; S45
  • FLUKA BRAND F CODES:3-10
  • Hazardous Material Identification: C
  • HazardClass:8
  • PackingGroup:III
  • Packing Group:III
  • Risk Phrases:R34
  • Packing Group:III
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

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