Chemical Properties of 9H-Purin-6-amine, N,N,9-trimethyl- (CAS 3013-82-9)

InChI

InChI=1S/C8H11N5/c1-12(2)7-6-8(10-4-9-7)13(3)5-11-6/h4-5H,1-3H3

InChI Key

GQKLJZOIXKFFQC-UHFFFAOYSA-N

Formula

C8H11N5

SMILES

CN(C)c1ncnc2c1ncn2C

Molecular Weight¹

177.21

CAS

3013-82-9

Other Names

• N,N,9-trimethyladenine

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 9H-Purin-6-amine, N,N,9-trimethyl-.

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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