Cas no 1196157-81-9 (Methyl (~12~C)formate)

Methyl (~12~C)formate structure
Methyl (~12~C)formate structure
Product Name:Methyl (~12~C)formate
CAS No:1196157-81-9
MF:C2H4O2
MW:60.0412607192993
CID:2952767
PubChem ID:16217414
Update Time:2025-04-21

Methyl (~12~C)formate Chemical and Physical Properties

Names and Identifiers

    • 甲酸甲酯-12C
    • Methyl (~12~C)formate
    • CID 16217414
    • Methyl formate-12C, 99.9 atom % 12C, 13C depleted
    • DTXSID80584378
    • 1196157-81-9
    • DTXCID80535143
    • Inchi: 1S/C2H4O2/c1-4-2-3/h2H,1H3/i2+0
    • InChI Key: TZIHFWKZFHZASV-ULIRUUBJSA-N
    • SMILES: O([12CH]=O)C

Computed Properties

  • Exact Mass: 60.021129366Da
  • Monoisotopic Mass: 60.021129366Da
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 4
  • Rotatable Bond Count: 1
  • Complexity: 18
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 26.3
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