2-Amino-4-Phenyl-5,6,7,8-Tetrahydro-4H-Chromene-3-Carbonitrile
[CAS# 164026-52-2]

Identification

• Name: 2-Amino-4-Phenyl-5,6,7,8-Tetrahydro-4H-Chromene-3-Carbonitrile
• Synonyms: 4H-1-Benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-4-phenyl-; TL8001255
• Molecular Formula: C₁₆H₁₆N₂O
• Molecular Weight: 252.31
• CAS Registry Number: 164026-52-2
• SMILES: N#C\C1=C(\O\C3=C(/C1c2ccccc2)CCCC3)N
• InChI: 1S/C16H16N2O/c17-10-13-15(11-6-2-1-3-7-11)12-8-4-5-9-14(12)19-16(13)18/h1-3,6-7,15H,4-5,8-9,18H2
• InChIKey: ZXQHIGYTTMBISV-UHFFFAOYSA-N

Properties

• Density: 1.219g/cm³ (Cal.)
• Melting point: 260°C (Expl.)
• Boiling point: 507.683°C at 760 mmHg (Cal.)
• Flash point: 260.837°C (Cal.)
• Refractive index: 1.625 (Cal.)