Cas no 51921-93-8 (Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester)

Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester structure
51921-93-8 structure
Product Name:Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester
CAS No:51921-93-8
MF:C19H26O3
MW:302.407946109772
CID:375034
PubChem ID:148548
Update Time:2025-04-19

Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester Chemical and Physical Properties

Names and Identifiers

    • Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester
    • (3-cyclopropyl-2-methyl-4-oxocyclopent-2-en-1-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
    • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3- cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester
    • 3-Cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate
    • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester
    • DTXSID70966245
    • 3-CYCLOPROPYL-2-METHYL-4-OXOCYCLOPENT-2-EN-1-YL 2,2-DIMETHYL-3-(2-METHYLPROP-1-EN-1-YL)CYCLOPROPANE-1-CARBOXYLATE
    • 51921-93-8
    • Inchi: 1S/C19H26O3/c1-10(2)8-13-17(19(13,4)5)18(21)22-15-9-14(20)16(11(15)3)12-6-7-12/h8,12-13,15,17H,6-7,9H2,1-5H3
    • InChI Key: ZXVLIUKUOVQECQ-UHFFFAOYSA-N
    • SMILES: O(C1CC(C(=C1C)C1CC1)=O)C(C1C(/C=C(\C)/C)C1(C)C)=O

Computed Properties

  • Exact Mass: 302.18828
  • Monoisotopic Mass: 302.188
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 5
  • Complexity: 586
  • 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
  • Surface Charge: 0
  • Tautomer Count: 5
  • XLogP3: nothing
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • Density: 1.1
  • Boiling Point: 395.1°Cat760mmHg
  • Flash Point: 170.7°C
  • Refractive Index: 1.532
  • PSA: 43.37

Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,3-cyclopropyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester Related Literature

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