N-[(2-Methylphenyl)Methyl]-2,4,8,9-Tetrazabicyclo[4.3.0]Nona-2,4,7,10-Tetraen-5-Amine
[CAS# 91769-03-8]

Identification

• Name: N-[(2-Methylphenyl)Methyl]-2,4,8,9-Tetrazabicyclo[4.3.0]Nona-2,4,7,10-Tetraen-5-Amine
• Synonyms: (2-Methylbenzyl)-(1H-Pyrazolo[4,3-E]Pyrimidin-4-Yl)Amine; Nsc25652
• Molecular Formula: C₁₃H₁₃N₅
• Molecular Weight: 239.28
• CAS Registry Number: 91769-03-8
• SMILES: C1=N[NH]C2=C1C(=NC=N2)NCC3=C(C)C=CC=C3
• InChI: 1S/C13H13N5/c1-9-4-2-3-5-10(9)6-14-12-11-7-17-18-13(11)16-8-15-12/h2-5,7-8H,6H2,1H3,(H2,14,15,16,17,18)
• InChIKey: WQLWDJKYTWTMES-UHFFFAOYSA-N

Properties

• Density: 1.344g/cm³ (Cal.)
• Boiling point: 476.061°C at 760 mmHg (Cal.)
• Flash point: 241.713°C (Cal.)