Diethyl-[2-[[4-(Propoxycarbonylamino)Benzoyl]Amino]Ethyl]Azanium Chloride
[CAS# 109966-65-6]

Identification

• Name: Diethyl-[2-[[4-(Propoxycarbonylamino)Benzoyl]Amino]Ethyl]Azanium Chloride
• Synonyms: Diethyl-[2-[[4-(Propoxycarbonylamino)Benzoyl]Amino]Ethyl]Ammonium Chloride; Diethyl-[2-[[Oxo-[4-[(Oxo-Propoxymethyl)Amino]Phenyl]Methyl]Amino]Ethyl]Ammonium Chloride; Diethyl-[2-[[4-(Propoxycarbonylamino)Phenyl]Carbonylamino]Ethyl]Azanium Chloride
• Molecular Formula: C₁₇H₂₈ClN₃O₃
• Molecular Weight: 357.88
• CAS Registry Number: 109966-65-6
• SMILES: C1=C(C=CC(=C1)C(NCC[NH+](CC)CC)=O)NC(OCCC)=O.[Cl-]
• InChI: 1S/C17H27N3O3.ClH/c1-4-13-23-17(22)19-15-9-7-14(8-10-15)16(21)18-11-12-20(5-2)6-3;/h7-10H,4-6,11-13H2,1-3H3,(H,18,21)(H,19,22);1H
• InChIKey: RPNBKFGQZFKPEK-UHFFFAOYSA-N

Properties

• Boiling point: 443.9°C at 760 mmHg (Cal.)
• Flash point: 222.3°C (Cal.)