Cas no 74135-13-0 (Sucrose Octasulfate, Ammonium Salt)

Sucrose Octasulfate, Ammonium Salt structure
74135-13-0 structure
Product Name:Sucrose Octasulfate, Ammonium Salt
CAS No:74135-13-0
MF:C12H46N8O35S8
MW:1119.04623556137
CID:826700
PubChem ID:18643587
Update Time:2025-04-19

Sucrose Octasulfate, Ammonium Salt Chemical and Physical Properties

Names and Identifiers

    • Sucrose Octasulfate, Ammonium Salt
    • ammonium salt of sucrose octasulfate
    • Sucrose Octasulfate,
    • octaazanium;[(2R,3R,4S,5R,6R)-2-[(2S,3S,4R,5R)-3,4-disulfonatooxy-2,5-bis(sulfonatooxymethyl)oxolan-2-yl]oxy-3,5-disulfonatooxy-6-(sulfonatooxymethyl)oxan-4-yl] sulfate
    • Sucrose Octasulfate octaAmmonium Salt
    • .ALPHA.-D-GLUCOPYRANOSIDE, 1,3,4,6-TETRA-O-SULFO-.BETA.-D-FRUCTOFURANOSYL, TETRAKIS(HYDROGEN SULFATE), AMMONIUM SALT
    • UNII-0M75U2ZH0A
    • 131587-92-3
    • Sucrosofate ammonium
    • Q27236962
    • 0M75U2ZH0A
    • .ALPHA.-D-GLUCOPYRANOSIDE, 1,3,4,6-TETRA-O-SULFO-.BETA.-D-FRUCTOFURANOSYL, TETRAKIS(HYDROGEN SULFATE), OCTAAMMONIUM SALT
    • alpha-D-Glucopyranoside, 1,3,4,6-tetra-O-sulfo-beta-D-fructofuranosyl, tetrakis(hydrogen sulfate), octaammonium salt
    • 74135-13-0
    • Inchi: 1S/C12H22O35S8.8H3N/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18;;;;;;;;/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);8*1H3/t4-,5-,6-,7-,8+,9-,10+,11-,12+;;;;;;;;/m1......../s1
    • InChI Key: LQOAWDYRUPQHRM-QRDGSJRXSA-N
    • SMILES: S(=O)(=O)([O-])O[C@H]1[C@@H]([C@@H](COS(=O)(=O)[O-])O[C@@]1(COS(=O)(=O)[O-])O[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](COS(=O)(=O)[O-])O1)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]

Computed Properties

  • Exact Mass: 991.74300
  • Monoisotopic Mass: 1117.9831246g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 35
  • Heavy Atom Count: 63
  • Rotatable Bond Count: 13
  • Complexity: 2130
  • Covalently-Bonded Unit Count: 9
  • Defined Atom Stereocenter Count: 9
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 634?2

Experimental Properties

  • Melting Point: 157-159°C dec.
  • Solubility: Water (Slightly)
  • PSA: 629.41000
  • LogP: -0.33510

Sucrose Octasulfate, Ammonium Salt Security Information

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