1-(Morpholinomethyl)Phenobarbital Hydrochloride
[CAS# 50309-45-0]

Identification

• Name: 1-(Morpholinomethyl)Phenobarbital Hydrochloride
• Synonyms: 5-Ethyl-1-(Morpholinomethyl)-5-Phenyl-Hexahydropyrimidine-2,4,6-Trione Hydrochloride; 5-Ethyl-1-(Morpholinomethyl)-5-Phenylhexahydropyrimidine-2,4,6-Trione Hydrochloride; 5-Ethyl-1-(Morpholinomethyl)-5-Phenyl-Barbituric Acid Hydrochloride
• Molecular Formula: C₁₇H₂₂ClN₃O₄
• Molecular Weight: 367.83
• CAS Registry Number: 50309-45-0
• SMILES: [H+].C3=C(C2(C(=O)N(CN1CCOCC1)C(=O)NC2=O)CC)C=CC=C3.[Cl-]
• InChI: 1S/C17H21N3O4.ClH/c1-2-17(13-6-4-3-5-7-13)14(21)18-16(23)20(15(17)22)12-19-8-10-24-11-9-19;/h3-7H,2,8-12H2,1H3,(H,18,21,23);1H
• InChIKey: OHAZESKFCAUFBA-UHFFFAOYSA-N

Properties

• Boiling point: 490.5°C at 760 mmHg (Cal.)
• Flash point: 250.5°C (Cal.)