3-{[5-(4-Chlorophenyl)-1H-pyrazol-3-yl]oxy}-N,N-dimethyl-1-propanamine (2E)-2-butenedioate (1:1)
[CAS# 86871-43-4]

Identification

• Name: 3-{[5-(4-Chlorophenyl)-1H-pyrazol-3-yl]oxy}-N,N-dimethyl-1-propanamine (2E)-2-butenedioate (1:1)
• Synonyms: 1-Propanamine, 3-((5-(4-chlorophenyl)-1H-pyrazol-3-yl)oxy)-N,N-dimethy-, (Z)-2-butenedioate (1:1); 3-p-Chlorophenyl-5-dimethylaminopropoxy-pyrazole maleate
• Molecular Formula: C₁₈H₂₂ClN₃O₅
• Molecular Weight: 395.84
• CAS Registry Number: 86871-43-4
• SMILES: O=C(O)\C=C\C(=O)O.Clc2ccc(c1cc(OCCCN(C)C)nn1)cc2
• InChI: 1S/C14H18ClN3O.C4H4O4/c1-18(2)8-3-9-19-14-10-13(16-17-14)11-4-6-12(15)7-5-11;5-3(6)1-2-4(7)8/h4-7,10H,3,8-9H2,1-2H3,(H,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: SOUCMKWRSJZNLQ-WLHGVMLRSA-N

Properties

• Boiling point: 454.4°C at 760 mmHg (Cal.)
• Flash point: 228.6°C (Cal.)