4-Chloro-6-(1-Piperidinyl)-2-Pyrimidinamine
[CAS# 104637-64-1]

Identification

• Name: 4-Chloro-6-(1-Piperidinyl)-2-Pyrimidinamine
• Synonyms: 4-Chloro-6-piperidin-1-ylpyrimidin-2-amine; 4-Chloro-6-piperidin-1-yl-pyrimidin-2-ylamine; 4-chloro-6-piperidino-2-pyrimidinamine
• Molecular Formula: C₉H₁₃ClN₄
• Molecular Weight: 212.68
• CAS Registry Number: 104637-64-1
• SMILES: c1c(nc(nc1Cl)N)N2CCCCC2
• InChI: 1S/C9H13ClN4/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,12,13)
• InChIKey: XXWWICKWOHZSQJ-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 156-160°C (Expl.)
• Boiling point: 440.6±55.0°C at 760 mmHg (Cal.)
• Flash point: 220.2±31.5°C (Cal.)
• Refractive index: 1.611 (Cal.)

Safety Data

• Safety Description: IRRITANT

References

• (1): K. F. Bowes, C. Glidewell, J. N. Low, M. Melguizo and A. Quesada. Two polymorphs, with Z' = 1 and 2, of 2-amino-4-chloro-6-morpholinopyrimidine in P21/c, and 2-amino-4-chloro-6-piperidinopyrimidine, which is isomorphous and almost isostructural with the Z' = 2 polym orph, Acta Cryst. (2003). C59, o4-o8