Cas no 7465-52-3 (Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester)

Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester structure
7465-52-3 structure
Product Name:Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester
CAS No:7465-52-3
MF:C20H32N2O12
MW:492.474287033081
CID:578211
PubChem ID:345496
Update Time:2025-04-19

Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester Chemical and Physical Properties

Names and Identifiers

    • Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester
    • 7465-52-3
    • dimethyl 4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitrodecanedioate
    • NSC-403137
    • NSC403137
    • DTXSID20323142
    • Inchi： 1S/C20H32N2O12/c1-31-15(23)5-9-19(21(27)28,10-6-16(24)32-2)13-14-20(22(29)30,11-7-17(25)33-3)12-8-18(26)34-4/h5-14H2,1-4H3
    • InChI Key： ROBBWICTEIZDHS-UHFFFAOYSA-N
    • SMILES： [O-][N+](C(CCC(=O)OC)(CCC(=O)OC)CCC(CCC(=O)OC)(CCC(=O)OC)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 492.19556
  • Monoisotopic Mass: 492.19552446g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 19
  • Complexity: 639
  • 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
  • XLogP3: 1
  • Topological Polar Surface Area: 197?2

Experimental Properties

  • PSA: 191.48

Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester Related Literature

7465-52-3 (Decanedioic acid,4,7-bis(3-methoxy-3-oxopropyl)-4,7-dinitro-, 1,10-dimethyl ester) Related Products

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