Cas no 102119-87-9 (Methyl 11-(2-pentylcyclopropen-1-yl)undecanoate)

Methyl 11-(2-pentylcyclopropen-1-yl)undecanoate structure
102119-87-9 structure
Product Name:Methyl 11-(2-pentylcyclopropen-1-yl)undecanoate
CAS No:102119-87-9
MF:C20H36O2
MW:308.498646736145
CID:1131928
PubChem ID:53743588
Update Time:2025-04-20

Methyl 11-(2-pentylcyclopropen-1-yl)undecanoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 11-(2-pentylcyclopropen-1-yl)undecanoate
    • METHYL 11-(2-PENTYLCYCLOPROP-1-EN-1-YL)UNDECANOATE
    • DTXSID80706356
    • SCHEMBL10628122
    • 1-Cyclopropene-1-undecanoic acid, 2-pentyl-, methyl ester
    • 102119-87-9
    • Inchi: 1S/C20H36O2/c1-3-4-11-14-18-17-19(18)15-12-9-7-5-6-8-10-13-16-20(21)22-2/h3-17H2,1-2H3
    • InChI Key: CWISCYLRBQRGJM-UHFFFAOYSA-N
    • SMILES: O(C)C(CCCCCCCCCCC1CC=1CCCCC)=O

Computed Properties

  • Exact Mass: 308.27153g/mol
  • Monoisotopic Mass: 308.27153g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 16
  • Complexity: 331
  • 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
  • Molecular Weight: 308.5g/mol
  • XLogP3: 6.8
  • Topological Polar Surface Area: 26.3?2
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