Desmethyl Ranitidine
[CAS# 66357-25-3]

Identification

• Name: Desmethyl Ranitidine
• Synonyms: (Z)-N'-Methyl-N-[2-[[5-(Methylaminomethyl)-2-Furyl]Methylsulfanyl]Ethyl]-2-Nitro-Ethene-1,1-Diamine; (Z)-N'-Methyl-N-[2-[[5-(Methylaminomethyl)-2-Furyl]Methylthio]Ethyl]-2-Nitroethene-1,1-Diamine; 2-[[5-(Methylaminomethyl)-2-Furyl]Methylthio]Ethyl-[(Z)-1-Methylamino-2-Nitro-Vinyl]Amine
• Molecular Formula: C₁₂H₂₀N₄O₃S
• Molecular Weight: 300.38
• CAS Registry Number: 66357-25-3
• SMILES: C1=C(CSCCNC(=C\[N+](=O)[O-])/NC)OC(=C1)CNC
• InChI: 1S/C12H20N4O3S/c1-13-7-10-3-4-11(19-10)9-20-6-5-15-12(14-2)8-16(17)18/h3-4,8,13-15H,5-7,9H2,1-2H3/b12-8-
• InChIKey: WZLBVRXZNDXPPW-WQLSENKSSA-N

Properties

• Density: 1.199g/cm³ (Cal.)
• Boiling point: 449.047°C at 760 mmHg (Cal.)
• Flash point: 225.376°C (Cal.)