N-{3-[(2-Cyanoethyl)(ethyl)amino]-4-methoxyphenyl}acetamide acetate (1:1)
[CAS# 84030-50-2]

Identification

• Name: N-{3-[(2-Cyanoethyl)(ethyl)amino]-4-methoxyphenyl}acetamide acetate (1:1)
• Synonyms: N-[3-[(2-cyanoethyl)ethylamino]-4-methoxyphenyl]acetamide monoacetate
• Molecular Formula: C₁₆H₂₃N₃O₄
• Molecular Weight: 321.37
• CAS Registry Number: 84030-50-2
• EINECS: 281-825-5
• SMILES: COc1ccc(cc1N(CC)CCC#N)NC(C)=O.CC(O)=O
• InChI: 1S/C14H19N3O2.C2H4O2/c1-4-17(9-5-8-15)13-10-12(16-11(2)18)6-7-14(13)19-3;1-2(3)4/h6-7,10H,4-5,9H2,1-3H3,(H,16,18);1H3,(H,3,4)
• InChIKey: FVSAWYTZJIYXAZ-UHFFFAOYSA-N

Properties

• Boiling point: 579.1°C at 760 mmHg (Cal.)
• Flash point: 304.1°C (Cal.)