Zinc diisobutyldithiocarbamate

• Catalog Number: ACM36190622-1
• Product Name: Zinc diisobutyldithiocarbamate
• CAS: 36190-62-2
• Category: Heterocyclic Organic Compound
• Synonyms: Bis(N,N-diisobutylthiocarbamoylthio) zinc
• IUPAC Name: Zinc;N,N-bis(2-methylpropyl)carbamodithioate
• Molecular Weight: 474.1
• Molecular Formula: C18H36N2Zn
• Canonical SMILES: CC(C)CN(CC(C)C)C(=S)[S-].CC(C)CN(CC(C)C)C(=S)[S-].[Zn+2]
• InChI: InChI=1S/2C9H19NS2.Zn/c2*1-7(2)5-10(9(11)12)6-8(3)4;/h2*7-8H,5-6H2,1-4H3,(H,11,12);/q;+2/p-2
• InChI Key: GOQCSVOOQKFAKT-UHFFFAOYSA-L
• Density: 1.24 g/cm3
• Complexity: 128
• Covalently-Bonded Unit Count: 3
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 472.105276
• Formal Charge: 0
• Heavy Atom Count: 25
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• Monoisotopic Mass: 472.105276
• Physical State: White powder
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 72.7 Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0