Predicted properties of the compound entered.

ID QJDZRXLGQGLJIY-UHFFFAOYSA-N
Formula C8H9N5O2
IUPAC Name ethyl 4-aminopyrazolo[3,2-c][1,2,4]triazine-3-carboxylate
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C8H9N5O2/c1-2-15-8(14)6-7(9)13-5(11-12-6)3-4-10-13/h3-4H,2,9H2,1H3
Standard InChIKey (User Input) InChIKey=QJDZRXLGQGLJIY-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate | 4-amino-3-pyrazolo[5,1-c][1,2,4]triazinecarboxylic acid ethyl ester | 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid ethyl ester | MLS000062408 | Pyrazolo[5,1-c]-as-triazine-3-carboxylic acid, 4-amino-, ethyl ester | Pyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 4-amino-, ethyl ester | ZINC00250358 | ChemDiv2_002636 | SMR000073099
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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13C NMR prediction -
COSY -
HSQC/HMBC prediction -
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