2-(1-Piperidinylmethyl)benzoic acid
[CAS# 917747-57-0]

Identification

• Name: 2-(1-Piperidinylmethyl)benzoic acid
• Synonyms: 2-piperazin-1-ylpyrazine; 2-Piperidin-1-ylmethyl-benzoic acid; 2-Pyrrolidin-1-ylmethyl-benzoic acid
• Molecular Formula: C₁₃H₁₇NO₂
• Molecular Weight: 219.28
• CAS Registry Number: 917747-57-0
• SMILES: OC(=O)c2ccccc2CN1CCCCC1
• InChI: 1S/C13H17NO2/c15-13(16)12-7-3-2-6-11(12)10-14-8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-10H2,(H,15,16)
• InChIKey: SETGNIQLYMGVGH-UHFFFAOYSA-N

Properties

• Density: 1.164g/cm³ (Cal.)
• Boiling point: 347.532°C at 760 mmHg (Cal.)
• Flash point: 163.982°C (Cal.)
• Refractive index: 1.58 (Cal.)

Safety Data

• Safety Description: IRRITANT