Cas no 73647-07-1 (Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt)

Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt structure
73647-07-1 structure
Product Name:Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt
CAS No:73647-07-1
MF:C16H27N6O6P
MW:430.395943880081
CID:1761762
PubChem ID:71313038
Update Time:2024-03-01

Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt Chemical and Physical Properties

Names and Identifiers

    • adenosine cyclic 2',3'-(hydrogen phosphate), compound with triethylamine (1:1)
    • Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt
    • Inchi: 1S/C10H12N5O6P.C6H15N/c11-8-5-9(13-2-12-8)15(3-14-5)10-7-6(4(1-16)19-10)20-22(17,18)21-7;1-4-7(5-2)6-3/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13);4-6H2,1-3H3/t4-,6-,7-,10-;/m1./s1
    • InChI Key: QVJJZPQQHXBBJK-MCDZGGTQSA-N
    • SMILES: P1(=O)([O-])O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O1)N1C=NC2C(N)=NC=NC1=2.[NH+](CC)(CC)CC

Computed Properties

  • Exact Mass: 430.17296960g/mol
  • Monoisotopic Mass: 430.17296960g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 5
  • Complexity: 516
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 162?2

Experimental Properties

  • Melting Point: >197oC (dec.)
  • Solubility: Methanol (Slightly), Water (Slightly)

Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt Security Information

Adenosine 2’,3’-Cyclic Phosphate Triethylammonium Salt Pricemore >>

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