3-Chloro-9-Methyl-N-Phenethyl-2,4,8,9-Tetrazabicyclo[4.3.0]Nona-1,3,5,7-Tetraen-5-Amine
[CAS# 6958-86-7]

Identification

• Name: 3-Chloro-9-Methyl-N-Phenethyl-2,4,8,9-Tetrazabicyclo[4.3.0]Nona-1,3,5,7-Tetraen-5-Amine
• Synonyms: 6-Chloro-1-Methyl-N-(2-Phenylethyl)-4-Pyrazolo[4,5-E]Pyrimidinamine; (6-Chloro-1-Methyl-Pyrazolo[4,5-E]Pyrimidin-4-Yl)-(2-Phenylethyl)Amine; 6-Chloro-1-Methyl-N-(2-Phenylethyl)-1H-Pyrazolo[3,4-D]Pyrimidin-4-Amine
• Molecular Formula: C₁₄H₁₄ClN₅
• Molecular Weight: 287.75
• CAS Registry Number: 6958-86-7
• SMILES: C1=N[N](C2=C1C(=NC(=N2)Cl)NCCC3=CC=CC=C3)C
• InChI: 1S/C14H14ClN5/c1-20-13-11(9-17-20)12(18-14(15)19-13)16-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,16,18,19)
• InChIKey: KRNAPVRIULRUAL-UHFFFAOYSA-N

Properties

• Density: 1.367g/cm³ (Cal.)