Cas no 61599-96-0 ([1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester)

[1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester structure
61599-96-0 structure
Product Name:[1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester
CAS No:61599-96-0
MF:C12H20O2
MW:196.286004066467
CID:473331
PubChem ID:71394239
Update Time:2025-04-19

[1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester
    • methyl 1-(2,3-dimethylcyclopropyl)-2,2-dimethylcyclopropane-1-carboxylate
    • DTXSID10815960
    • Methyl 2,2,2',3'-tetramethyl[1,1'-bi(cyclopropane)]-1-carboxylate
    • 61599-96-0
    • Inchi： 1S/C12H20O2/c1-7-8(2)9(7)12(10(13)14-5)6-11(12,3)4/h7-9H,6H2,1-5H3
    • InChI Key： ZIOLUFNLIPAHPV-UHFFFAOYSA-N
    • SMILES： O(C)C(C1(CC1(C)C)C1C(C)C1C)=O

Computed Properties

  • Exact Mass: 196.1464
  • Monoisotopic Mass: 196.146329876g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 274
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3

[1,1'-Bicyclopropyl]-1-carboxylic acid, 2,2,2',3'-tetramethyl-, methyl ester Related Literature

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