3-[(4-Hydroxy-1-piperidinyl)methyl]benzonitrile
[CAS# 887593-83-1]

Identification

• Name: 3-[(4-Hydroxy-1-piperidinyl)methyl]benzonitrile
• Synonyms: 3-(4-HYDROXY-PIPERIDIN-1-YLMETHYL)-BENZONITRILE; 3-[(4-hydroxypiperidin-1-yl)methyl]benzonitrile; BENZONITRILE,3-[(4-HYDROXY-1-PIPERIDINYL)METHYL]-
• Molecular Formula: C₁₃H₁₆N₂O
• Molecular Weight: 216.28
• CAS Registry Number: 887593-83-1
• SMILES: N#Cc2cc(CN1CCC(O)CC1)ccc2
• InChI: 1S/C13H16N2O/c14-9-11-2-1-3-12(8-11)10-15-6-4-13(16)5-7-15/h1-3,8,13,16H,4-7,10H2
• InChIKey: YNJNHBRCZOTORQ-UHFFFAOYSA-N

Properties

• Density: 1.173g/cm³ (Cal.)
• Boiling point: 385.352°C at 760 mmHg (Cal.)
• Flash point: 186.854°C (Cal.)
• Refractive index: 1.592 (Cal.)