Cas no 2169496-17-5 (1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid)

1-Cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid is a specialized cyclopropane derivative featuring a cycloheptyl substituent and a carboxyl functional group. Its unique structure, combining a strained cyclopropane ring with a bulky cycloheptyl moiety, makes it a valuable intermediate in organic synthesis, particularly for studying ring-strain reactivity and steric effects. The presence of the carboxylic acid group enhances its utility in derivatization reactions, enabling applications in pharmaceuticals, agrochemicals, and material science. The compound's stability and defined stereochemistry further support its use in precision synthesis. Its structural attributes make it suitable for exploring novel reaction pathways and developing functionalized cyclopropane-based compounds.
1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid structure
2169496-17-5 structure
Product Name:1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid
CAS No:2169496-17-5
MF:C13H22O2
MW:210.312584400177
CID:5968307
PubChem ID:165764364
Update Time:2025-05-27

1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid
    • 2169496-17-5
    • EN300-1762645
    • Inchi: 1S/C13H22O2/c1-12(2)9-13(12,11(14)15)10-7-5-3-4-6-8-10/h10H,3-9H2,1-2H3,(H,14,15)
    • InChI Key: UIBHPXABQAZSMK-UHFFFAOYSA-N
    • SMILES: OC(C1(C2CCCCCC2)CC1(C)C)=O

Computed Properties

  • Exact Mass: 210.161979940g/mol
  • Monoisotopic Mass: 210.161979940g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 262
  • 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: 4.2
  • Topological Polar Surface Area: 37.3?2

1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1762645-1g
1-cycloheptyl-2,2-dimethylcyclopropane-1-carboxylic acid
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Enamine
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Enamine
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