7-(2-Aminoethyl)-1,3-Dimethylpurine-2,6-Dione Hydrochloride
[CAS# 74039-63-7]

Identification

• Name: 7-(2-Aminoethyl)-1,3-Dimethylpurine-2,6-Dione Hydrochloride
• Synonyms: 7-(2-Aminoethyl)-1,3-Dimethyl-Purine-2,6-Dione Hydrochloride; 7-(2-Aminoethyl)-1,3-Dimethyl-Xanthine Hydrochloride; 7-(2-Aminoethyl)-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione Hydrochloride
• Molecular Formula: C₉H₁₄ClN₅O₂
• Molecular Weight: 259.69
• CAS Registry Number: 74039-63-7
• EINECS: 277-678-1
• SMILES: [H+].C1=NC2=C([N]1CCN)C(=O)N(C(=O)N2C)C.[Cl-]
• InChI: 1S/C9H13N5O2.ClH/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7;/h5H,3-4,10H2,1-2H3;1H
• InChIKey: POOHRJCIRTYEQE-UHFFFAOYSA-N

Properties

• Boiling point: 470.7°C at 760 mmHg (Cal.)
• Flash point: 238.5°C (Cal.)