Chemical Properties of 1H-Pyrazolo[4,3-d]pyrimidin-7-amine (CAS 13877-56-0)

InChI

InChI=1S/C5H5N5/c6-5-4-3(1-9-10-4)7-2-8-5/h1-2H,(H,9,10)(H2,6,7,8)

InChI Key

MPDXYVOXVJOKIN-UHFFFAOYSA-N

Formula

C5H5N5

SMILES

Nc1ncnc2c[nH]nc12

Molecular Weight¹

135.13

CAS

13877-56-0

Other Names

• 1H-Pyrazolo[4,3-d]pyrimidine, 7-amino-
• 7-Aminopyrazolo[4,3-d]-pyrimidine

• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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 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

Find more compounds similar to 1H-Pyrazolo[4,3-d]pyrimidin-7-amine.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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