Cas no 62527-80-4 (Propanedioic acid, propoxy-, dipropyl ester)

Propanedioic acid, propoxy-, dipropyl ester structure
62527-80-4 structure
Product Name:Propanedioic acid, propoxy-, dipropyl ester
CAS No:62527-80-4
MF:C12H22O5
MW:246.300084590912
CID:441526
PubChem ID:14288975
Update Time:2025-04-19

Propanedioic acid, propoxy-, dipropyl ester Chemical and Physical Properties

Names and Identifiers

    • Propanedioic acid, propoxy-, dipropyl ester
    • dipropyl 2-propoxypropanedioate
    • 62527-80-4
    • DTXSID30558483
    • Dipropyl propoxypropanedioate
    • Inchi: 1S/C12H22O5/c1-4-7-15-10(11(13)16-8-5-2)12(14)17-9-6-3/h10H,4-9H2,1-3H3
    • InChI Key: FUDDURALUOFQNI-UHFFFAOYSA-N
    • SMILES: O(CCC)C(C(=O)OCCC)C(=O)OCCC

Computed Properties

  • Exact Mass: 246.14676
  • Monoisotopic Mass: 246.14672380g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 11
  • Complexity: 207
  • 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: 2.8
  • Topological Polar Surface Area: 61.8?2

Experimental Properties

  • PSA: 61.83
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