(3-{[2-(4-Morpholinyl)ethyl]carbamoyl}phenyl)boronic acid hydrochloride (1:1)
[CAS# 957060-89-8]

Identification

• Name: (3-{[2-(4-Morpholinyl)ethyl]carbamoyl}phenyl)boronic acid hydrochloride (1:1)
• Synonyms: (3-((2-Morpholinoethyl)carbamoyl)phenyl)boronic acid hydrochloride; (3-((2-Morpholinoethyl)carbamoyl)phenyl)-boronic acid hydrochloride; 3-(2-Morpholinoethyl carbamoyl)phenylboronic acid hydrochloride
• Molecular Formula: C₁₃H₂₀BClN₂O₄
• Molecular Weight: 314.57
• CAS Registry Number: 957060-89-8
• SMILES: B(C1=CC(=CC=C1)C(=O)NCCN2CCOCC2)(O)O.Cl
• InChI: 1S/C13H19BN2O4.ClH/c17-13(11-2-1-3-12(10-11)14(18)19)15-4-5-16-6-8-20-9-7-16;/h1-3,10,18-19H,4-9H2,(H,15,17);1H
• InChIKey: QBUJRGQOXYFCFK-UHFFFAOYSA-N

Properties

• Melting point: 190-195°C (Expl.)
• Refractive index: (Cal.)

Safety Data

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