Cas no 25677-88-7 (Pentanedioic acid,2,2-dimethyl-, 1,5-bis(2-oxiranylmethyl) ester)

Pentanedioic acid,2,2-dimethyl-, 1,5-bis(2-oxiranylmethyl) ester structure
25677-88-7 structure
Product Name:Pentanedioic acid,2,2-dimethyl-, 1,5-bis(2-oxiranylmethyl) ester
CAS No:25677-88-7
MF:C13H20O6
MW:272.294304847717
CID:255575
PubChem ID:117271
Update Time:2025-04-19

Pentanedioic acid,2,2-dimethyl-, 1,5-bis(2-oxiranylmethyl) ester Chemical and Physical Properties

Names and Identifiers

    • Pentanedioic acid,2,2-dimethyl-, 1,5-bis(2-oxiranylmethyl) ester
    • bis(oxiran-2-ylmethyl) 2,2-dimethylpentanedioate
    • Bis(2,3-epoxypropyl) 2,2-dimethylglutarate
    • EINECS 247-180-9
    • NS00048244
    • 25677-88-7
    • SCHEMBL1700384
    • Bis[(oxiran-2-yl)methyl] 2,2-dimethylpentanedioate
    • DTXSID80948557
    • Inchi: 1S/C13H20O6/c1-13(2,12(15)19-8-10-6-17-10)4-3-11(14)18-7-9-5-16-9/h9-10H,3-8H2,1-2H3
    • InChI Key: XFIRMLBRMBPHRH-UHFFFAOYSA-N
    • SMILES: O1CC1COC(C(C)(C)CCC(=O)OCC1CO1)=O

Computed Properties

  • Exact Mass: 272.126
  • Monoisotopic Mass: 272.12598835g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 10
  • Complexity: 351
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.5
  • Topological Polar Surface Area: 77.7?2

Experimental Properties

  • PSA: 77.66
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