Cas no 72733-64-3 (Spiro[2.2]pentanecarboxylic acid, 2,2-dicyclopropyl-, methyl ester)

Spiro[2.2]pentanecarboxylic acid, 2,2-dicyclopropyl-, methyl ester structure
72733-64-3 structure
Product Name:Spiro[2.2]pentanecarboxylic acid, 2,2-dicyclopropyl-, methyl ester
CAS No:72733-64-3
MF:C13H18O2
MW:206.280824184418
CID:543502
PubChem ID:12536955
Update Time:2025-04-19

Spiro[2.2]pentanecarboxylic acid, 2,2-dicyclopropyl-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Spiro[2.2]pentanecarboxylic acid, 2,2-dicyclopropyl-, methyl ester
    • methyl 2,2-dicyclopropylspiro[2.2]pentane-1-carboxylate
    • 72733-64-3
    • DTXSID60501689
    • Inchi: 1S/C13H18O2/c1-15-11(14)10-12(6-7-12)13(10,8-2-3-8)9-4-5-9/h8-10H,2-7H2,1H3
    • InChI Key: POBOQXCUHSXMIR-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C2(CC2)C1(C1CC1)C1CC1)=O

Computed Properties

  • Exact Mass: 206.13074
  • Monoisotopic Mass: 206.130679813g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 322
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3
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