Cas no 91057-94-2 (1,2-Cyclopropanedicarboxylic acid, 1-methyl-, diethyl ester)

1,2-Cyclopropanedicarboxylic acid, 1-methyl-, diethyl ester structure
91057-94-2 structure
Product Name:1,2-Cyclopropanedicarboxylic acid, 1-methyl-, diethyl ester
CAS No:91057-94-2
MF:C10H16O4
MW:200.231643676758
CID:788151
PubChem ID:10397886
Update Time:2025-04-19

1,2-Cyclopropanedicarboxylic acid, 1-methyl-, diethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1,2-Cyclopropanedicarboxylic acid, 1-methyl-, diethyl ester
    • diethyl 1-methylcyclopropane-1,2-dicarboxylate
    • SCHEMBL13415371
    • 91057-94-2
    • DTXSID00439235
    • E88157
    • Inchi: 1S/C10H16O4/c1-4-13-8(11)7-6-10(7,3)9(12)14-5-2/h7H,4-6H2,1-3H3
    • InChI Key: JAVFLVRTAYJTHK-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1(C)CC1C(=O)OCC)=O

Computed Properties

  • Exact Mass: 200.10485899g/mol
  • Monoisotopic Mass: 200.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 6
  • Complexity: 249
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 52.6?2
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