Cas no 4440-07-7 (ethyl(propyl)propanedioic acid)

ethyl(propyl)propanedioic acid structure
4440-07-7 structure
Product Name:ethyl(propyl)propanedioic acid
CAS No:4440-07-7
MF:C8H14O4
MW:174.194363117218
CID:1518576
PubChem ID:23422956
Update Time:2025-09-23

ethyl(propyl)propanedioic acid Chemical and Physical Properties

Names and Identifiers

    • ethyl(propyl)propanedioic acid
    • Ethyl(propyl)malonic acid
    • propanedioic acid, 2-ethyl-2-propyl-
    • Ethyl(propyl)malonic acid; propanedioic acid, 2-ethyl-2-propyl-
    • EN300-703922
    • 2-Ethyl-2-propylmalonic acid
    • 2-ethyl-2-propylpropanedioic acid
    • SCHEMBL1033008
    • Athylpropylmalonsaure
    • 4440-07-7
    • Inchi： 1S/C8H14O4/c1-3-5-8(4-2,6(9)10)7(11)12/h3-5H2,1-2H3,(H,9,10)(H,11,12)
    • InChI Key： GDYPOKOVVJLYCE-UHFFFAOYSA-N
    • SMILES： OC(C(C(=O)O)(CC)CCC)=O

Computed Properties

  • Exact Mass: 174.08922
  • Monoisotopic Mass: 174.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 172
  • 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: 1.7
  • Topological Polar Surface Area: 74.6?2

Experimental Properties

  • PSA: 74.6

ethyl(propyl)propanedioic acid Pricemore >>

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