3-Amino-4-Chloro-5-Methyl-4-Nitro-2-Cyclopentene-1,1,2-Tricarbonitrile
[CAS# 118644-90-9]

Identification

• Name: 3-Amino-4-Chloro-5-Methyl-4-Nitro-2-Cyclopentene-1,1,2-Tricarbonitrile
• Synonyms: 2-Amino-3-nitro-3-chloro-4-methyl-1,5,5-tricyano-1-cyclopentene; 3-Amino-4-chloro-4-(hydroxy(oxido)amino)-5-methyl-2-cyclopentene-1,1,2-tricarbonitrile; 3-Amino-4-chloro-5-methyl-4-nitro-2-cyclopentene-1,1,2-tricarbonitrile
• Molecular Formula: C₉H₆ClN₅O₂
• Molecular Weight: 251.63
• CAS Registry Number: 118644-90-9
• SMILES: CC1C(C(=C(C1([N+](=O)[O-])Cl)N)C#N)(C#N)C#N
• InChI: 1S/C9H6ClN5O2/c1-5-8(3-12,4-13)6(2-11)7(14)9(5,10)15(16)17/h5H,14H2,1H3
• InChIKey: CWRGCDKIXIGGAV-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 653.5±55.0°C at 760 mmHg (Cal.)
• Flash point: 349.0±31.5°C (Cal.)
• Refractive index: 1.599 (Cal.)