Chemical Properties of 6-Chloro-2,4-dihydroxy-1,3-dimethylpyrimidine (CAS 6972-27-6)

InChI

InChI=1S/C6H7ClN2O2/c1-8-4(7)3-5(10)9(2)6(8)11/h3H,1-2H3

InChI Key

VATQPUHLFQHDBD-UHFFFAOYSA-N

Formula

C6H7ClN2O2

SMILES

Cn1c(Cl)cc(=O)n(C)c1=O

Molecular Weight¹

174.59

CAS

6972-27-6

Other Names

• 6-Chloro-1,3-dimethyluracil
• 1,3-Dimethyl-4-chlorouracil
• 2,4(1H,3H)-Pyrimidinedione, 6-chloro-1,3-dimethyl-

• 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_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

Similar Compounds

Find more compounds similar to 6-Chloro-2,4-dihydroxy-1,3-dimethylpyrimidine.

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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