3-Amino-1,2-Benzoxazole-5-Carbonitrile
[CAS# 201157-76-8]

Identification

• Name: 3-Amino-1,2-Benzoxazole-5-Carbonitrile
• Synonyms: 3-aminobenzo[d]isoxazole-5-carbonitrile
• Molecular Formula: C₈H₅N₃O
• Molecular Weight: 159.14
• CAS Registry Number: 201157-76-8
• SMILES: N#Cc1cc2c(cc1)onc2N
• InChI: 1S/C8H5N3O/c9-4-5-1-2-7-6(3-5)8(10)11-12-7/h1-3H,(H2,10,11)
• InChIKey: BLJRIFKEHDJSNZ-UHFFFAOYSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 408.53°C at 760 mmHg (Cal.)
• Flash point: 200.872°C (Cal.)
• Refractive index: 1.682 (Cal.)