7-(Butylamino)-2-[(5-Chloro-2-Methylphenyl)Amino]-5-Methyl-1H-[1,2,4]Triazolo[1,5-A]Pyrimidin-8-Ium

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Properties Simple | Detailed

Formula C17H22ClN6+
IUPAC Name n'-butyl-n-(5-chloro-2-methylphenyl)-5-methyl-1h-[1,2,4]triazolo[5,1-b]pyrimidin-8-ium-2,7-diamine
Molecular Mass 345.850 g·mol−1
Heat of Formation 366.6 ± 16.7 kJ·mol−1
Dipole Moment 10.37 ± 1.08 D
Volume 409.82 Å 3
Surface Area 384.73 Å 2
Point Group Symmetry C1
Synonyms
  • butyl-[2-[(5-chloro-2-methyl-phenyl)amino]-5-methyl-1h-[1,2,4]triazolo[5,1-b]pyrimidin-8-ium-7-yl]amine
  • n'-butyl-n-(5-chloro-2-methyl-phenyl)-5-methyl-1h-[1,2,4]triazolo[5,1-b]pyrimidin-8-ium-2,7-diamine
InChIKey PGCXDOVGAQXAAS-UHFFFAOYSA-O
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Elements H C N Cl