1-Octylguanidine Hemisulfate
[CAS# 21409-35-8]

Identification

• Classification: Chemical reagent >> Organic reagent >> Guanidine salt
• Name: 1-Octylguanidine Hemisulfate
• Synonyms: (Azaniumylcarbonimidoyl)-Octyl-Ammonium Sulfate; (Ammonio-Iminomethyl)-Octylammonium Sulfate; (Ammoniocarbonimidoyl)-Octyl-Ammonium Sulfate
• Molecular Formula: C₉H₂₃N₃O₄S
• Molecular Weight: 269.36
• CAS Registry Number: 21409-35-8 (3038-42-4)
• SMILES: O=[S]([O-])([O-])=O.C([NH2+]C([NH3+])=N)CCCCCCC
• InChI: 1S/C9H21N3.H2O4S/c1-2-3-4-5-6-7-8-12-9(10)11;1-5(2,3)4/h2-8H2,1H3,(H4,10,11,12);(H2,1,2,3,4)
• InChIKey: WXDMRAWLKABMCM-UHFFFAOYSA-N

Properties

• Boiling point: 250°C at 760 mmHg (Cal.)
• Flash point: 105°C (Cal.)