2-Amino-N-(1-Ethyl-3-Pyrrolidinyl)-4-Methoxy-5-Pyrimidinecarboxamide (E)-2-Butenedioate (1:1)
[CAS# 84332-17-2]

Identification

• Name: 2-Amino-N-(1-Ethyl-3-Pyrrolidinyl)-4-Methoxy-5-Pyrimidinecarboxamide (E)-2-Butenedioate (1:1)
• Synonyms: 2-Amino-N-(1-Ethylpyrrolidin-3-Yl)-4-Methoxy-Pyrimidine-5-Carboxamide; But-2-Enedioic Acid; 2-Amino-N-(1-Ethyl-3-Pyrrolidinyl)-4-Methoxy-5-Pyrimidinecarboxamide; But-2-Enedioic Acid; 5-Pyrimidinecarboxamide, 2-Amino-N-(1-Ethyl-3-Pyrrolidinyl)-4-Methoxy-, (E)-2-Butenedioate (1:1)
• Molecular Formula: C₁₆H₂₃N₅O₆
• Molecular Weight: 381.39
• CAS Registry Number: 84332-17-2
• SMILES: C1=C(C(=NC(=N1)N)OC)C(=O)NC2CN(CC2)CC.O=C(O)\C=C\C(=O)O
• InChI: 1S/C12H19N5O2.C4H4O4/c1-3-17-5-4-8(7-17)15-10(18)9-6-14-12(13)16-11(9)19-2;5-3(6)1-2-4(7)8/h6,8H,3-5,7H2,1-2H3,(H,15,18)(H2,13,14,16);1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: JGJKDXAVNJHAAJ-WLHGVMLRSA-N

Properties

• Boiling point: 719.9°C at 760 mmHg (Cal.)
• Flash point: 389.2°C (Cal.)