[4-Chloro-3-(1-piperidinylcarbonyl)phenyl]boronic acid
[CAS# 871332-70-6]

Identification

• Name: [4-Chloro-3-(1-piperidinylcarbonyl)phenyl]boronic acid
• Synonyms: (4-Chloro-3-(piperidine-1-carbonyl)phenyl)boronic acid; (4-Chloro-3-(piperidine-1-carbonyl)-phenyl)boronic acid; (5-Borono-2-chlorophenyl)carbonylpiperidine
• Molecular Formula: C₁₂H₁₅BClNO₃
• Molecular Weight: 267.52
• CAS Registry Number: 871332-70-6
• SMILES: B(C1=CC(=C(C=C1)Cl)C(=O)N2CCCCC2)(O)O
• InChI: 1S/C12H15BClNO3/c14-11-5-4-9(13(17)18)8-10(11)12(16)15-6-2-1-3-7-15/h4-5,8,17-18H,1-3,6-7H2
• InChIKey: QNOMMSMMADZNCM-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 152-156°C (Expl.)
• Boiling point: 500.0±55.0°C at 760 mmHg (Cal.)
• Flash point: 256.2±31.5°C (Cal.)
• Refractive index: 1.59 (Cal.)

Safety Data

• Safety Code: S26;S37;S60
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: IRRITANT