N-4-Isopropylbenzylglucamine Dithiocarbamate
[CAS# 111811-14-4]

Identification

• Name: N-4-Isopropylbenzylglucamine Dithiocarbamate
• Synonyms: [(4-Isopropylphenyl)Methyl-(2,3,4,5,6-Pentahydroxyhexyl)Amino]Methanedithioic Acid; [(4-Isopropylbenzyl)-(2,3,4,5,6-Pentahydroxyhexyl)Amino]Methanedithioic Acid; D-Glucitol, 1-Deoxy-1-((Dithiocarboxy)((4-(1-Methylethyl)Phenyl)Methyl)Amino)-
• Molecular Formula: C₁₇H₂₇NO₅S₂
• Molecular Weight: 389.52
• CAS Registry Number: 111811-14-4
• SMILES: C1=C(C=CC(=C1)C(C)C)CN(C(S)=S)CC(C(C(C(CO)O)O)O)O
• InChI: 1S/C17H27NO5S2/c1-10(2)12-5-3-11(4-6-12)7-18(17(24)25)8-13(20)15(22)16(23)14(21)9-19/h3-6,10,13-16,19-23H,7-9H2,1-2H3,(H,24,25)
• InChIKey: JEQPSYBWBTWNHF-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 630.445°C at 760 mmHg (Cal.)
• Flash point: 335.082°C (Cal.)