Cas no 65611-53-2 (1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester)

1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester structure
65611-53-2 structure
Product Name:1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester
CAS No:65611-53-2
MF:C10H14N2O4
MW:226.229162693024
MDL:MFCD01540635
CID:398229
PubChem ID:653376
Update Time:2025-04-19

1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester
    • diethyl 2-methyl-1H-imidazole-4,5-dicarboxylate
    • CHEMBL1622705
    • NCGC00073328-02
    • DTXSID00349567
    • AB00475194-09
    • EU-0019119
    • YJQMMRDTIAPJRX-UHFFFAOYSA-N
    • AKOS000732405
    • 65611-53-2
    • ST4058398
    • SCHEMBL7885220
    • diethyl 2-methylimidazole-4,5-dicarboxylate
    • SR-01000530886
    • SR-01000530886-1
    • 2-Methyl-1H-imidazole-4,5-dicarboxylic acid diethyl ester
    • 4,5-DIETHYL 2-METHYL-1H-IMIDAZOLE-4,5-DICARBOXYLATE
    • MFCD01540635
    • MDL: MFCD01540635
    • Inchi: 1S/C10H14N2O4/c1-4-15-9(13)7-8(10(14)16-5-2)12-6(3)11-7/h4-5H2,1-3H3,(H,11,12)
    • InChI Key: YJQMMRDTIAPJRX-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1=C(C(=O)OCC)N=C(C)N1)=O

Computed Properties

  • Exact Mass: 226.09542
  • Monoisotopic Mass: 226.09535693g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 270
  • 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: 1.6
  • Topological Polar Surface Area: 81.3?2

Experimental Properties

  • PSA: 81.28

1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB475377-1 g
2-Methyl-1H-imidazole-4,5-dicarboxylic acid diethyl ester
65611-53-2
1g
€452.00 2023-07-18
abcr
AB475377-1g
2-Methyl-1H-imidazole-4,5-dicarboxylic acid diethyl ester; .
65611-53-2
1g
€452.00 2025-04-17
abcr
AB475377-5g
2-Methyl-1H-imidazole-4,5-dicarboxylic acid diethyl ester; .
65611-53-2
5g
€1408.60 2025-04-17

1H-Imidazole-4,5-dicarboxylic acid, 2-methyl-, diethyl ester Related Literature

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