Cas no 61350-84-3 (Cyclopropaneheptanoic acid, decyl ester)

Cyclopropaneheptanoic acid, decyl ester structure
61350-84-3 structure
Product Name:Cyclopropaneheptanoic acid, decyl ester
CAS No:61350-84-3
MF:C20H38O2
MW:310.514526844025
CID:482907
PubChem ID:21496556
Update Time:2025-04-19

Cyclopropaneheptanoic acid, decyl ester Chemical and Physical Properties

Names and Identifiers

    • Cyclopropaneheptanoic acid, decyl ester
    • decyl 7-cyclopropylheptanoate
    • DTXSID40614983
    • SCHEMBL11848872
    • 61350-84-3
    • Inchi: 1S/C20H38O2/c1-2-3-4-5-6-7-10-13-18-22-20(21)15-12-9-8-11-14-19-16-17-19/h19H,2-18H2,1H3
    • InChI Key: HOUJUIJEYOOGOP-UHFFFAOYSA-N
    • SMILES: O(CCCCCCCCCC)C(CCCCCCC1CC1)=O

Computed Properties

  • Exact Mass: 310.28734
  • Monoisotopic Mass: 310.287180451g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 17
  • Complexity: 258
  • 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: 8.2
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3
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