6-Chloro-N⁴,N⁴-Diethyl-2,4-Pyrimidinediamine
[CAS# 116895-09-1]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Aminopyrimidine
• Name: 6-Chloro-N⁴,N⁴-Diethyl-2,4-Pyrimidinediamine
• Synonyms: (2-amino-6-chloropyrimidin-4-yl)diethylamine; 2-Amino-6-chloro-4-(diethylamino)pyrimidine; 6-Chloro-N*4*,N*4*-diethyl-pyrimidine-2,4-diamine
• Molecular Formula: C₈H₁₃ClN₄
• Molecular Weight: 200.67
• CAS Registry Number: 116895-09-1
• SMILES: CCN(CC)C1=CC(=NC(=N1)N)Cl
• InChI: 1S/C8H13ClN4/c1-3-13(4-2)7-5-6(9)11-8(10)12-7/h5H,3-4H2,1-2H3,(H2,10,11,12)
• InChIKey: JZPXSIGRVGTURL-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Melting point: 104-106°C (Expl.)
• Boiling point: 395.4±45.0°C at 760 mmHg (Cal.)
• Flash point: 192.9±28.7°C (Cal.)
• Refractive index: 1.6 (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: IRRITANT