4-(1H-Indol-3-ylmethylene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carboximidamide acetate (1:1)
[CAS# 84696-88-8]

Identification

• Name: 4-(1H-Indol-3-ylmethylene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carboximidamide acetate (1:1)
• Synonyms: 4,5-dihydro-4-(1H-indol-3-ylmethylene)-3-methyl-5-oxo-1H-pyrazole-1-carboxamidine monoacetate
• Molecular Formula: C₁₆H₁₇N₅O₃
• Molecular Weight: 327.34
• CAS Registry Number: 84696-88-8
• EINECS: 283-696-0
• SMILES: CC(O)=O.NC(=N)N3/N=C(/C)C(=Cc2cnc1ccccc12)C3=O
• InChI: 1S/C14H13N5O.C2H4O2/c1-8-11(13(20)19(18-8)14(15)16)6-9-7-17-12-5-3-2-4-10(9)12;1-2(3)4/h2-7,17H,1H3,(H3,15,16);1H3,(H,3,4)
• InChIKey: JIXFYFMUVAVXTD-UHFFFAOYSA-N

Properties

• Boiling point: 596.1°C at 760 mmHg (Cal.)
• Flash point: 314.3°C (Cal.)