Chemical Properties of 4,5-Imidazoledicarboxylic acid (CAS 570-22-9)

4,5-Imidazoledicarboxylic acid

InChI
InChI=1S/C5H4N2O4/c8-4(9)2-3(5(10)11)7-1-6-2/h1H,(H,6,7)(H,8,9)(H,10,11)
InChI Key
ZEVWQFWTGHFIDH-UHFFFAOYSA-N
Formula
C5H4N2O4
SMILES
O=C(O)c1nc[nH]c1C(=O)O
Molecular Weight1
156.10
CAS
570-22-9
Other Names
  • 1H-Imidazole-4,5-dicarboxylic acid
  • 4,5-Dicarboxyimidazole
  • 4,5-Imidazoledicarboxylate
  • Glycoxalinedicarboxylic acid
  • Glyoxalinedicarboxylic acid
  • Imidazole-4,5-dicarboxylic acid
  • NSC 9236
  • «alpha»,«beta»-Imidazoledicarboxylic acid
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Physical Properties

Property Value Unit Source
logPoct/wat -0.676 Crippen Calculated Property
McVol 96.690 ml/mol McGowan Calculated Property
Tfus 561.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Dimethyl 4,5-imidazole-dicarboxylate. 1H-Imidazole-4-methanol, 5-methyl-. Methyl 4-(2«lambda»5-1,2-triazadienyl)-1h-imidazole-5-carboxylate. 4-Imidazolecarboxylic acid, 5-(dimethyl-1-triazeno)-, butyl ester. 5-IMIDAZOLIC ACID, 4-NITRO-, METHYL(ESTER). Imidazole-4-carboxamide, n-butyl-5-nitro-. Imidazole-4(or 5)-carboxamide, n-benzyl-5(or 4)-(benzylamino)-. Ethyl 4-nitro-1h-imidazole-5-carboxylate. RTI 5. Tetrazepam M (norhydroxy-), hydrolysis, acetylated. 5-(4-Oxopentanoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine. 4-Imidazole carboxylic acid, 5[3-(beta-hydroxyethyl)-3-methyl-1-triazeno]-, methyl ester. Tetrazepam M (hydroxy-), isomer 1, hydrolysis, acetylated. GA34-2-O-Glc (17-D2), permethylated. Propanoic acid, 2-[(4-aminocarbonylimidazol-5-yl)-1-triazen-1,3-diyl-], ethyl ester.

Find more compounds similar to 4,5-Imidazoledicarboxylic acid.

Sources

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