Dipentamethylenethiuram hexasulfide

• CAS: 971-15-3
• Catalog Number: ACM971153-1
• Category: Other Products
• Molecular Weight: 448.8
• Molecular Formula: C12H20N2S8
• Synonyms: 1,6-Hexasulfanediylbis(1-piperidinylmethanethione)
• IUPAC Name: (Piperidine-1-carbothioylpentasulfanyl) piperidine-1-carbodithioate
• Canonical SMILES: C1CCN(CC1)C(=S)SSSSSSC(=S)N2CCCCC2
• InChI: InChI=1S/C12H20N2S8/c15-11(13-7-3-1-4-8-13)17-19-21-22-20-18-12(16)14-9-5-2-6-10-14/h1-10H2
• InChI Key: HPFHYRNETZEPIV-UHFFFAOYSA-N
• Boiling Point: 578.4±33.0 °C
• Melting Point: 135-136 °C
• Density: 1.518±0.06 g/cm3
• Complexity: 321
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 447.939218
• Formal Charge: 0
• Heavy Atom Count: 22
• Hydrogen Bond Acceptor Count: 8
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• Monoisotopic Mass: 447.939218
• Physical State: Pale yellow powder
• Rotatable Bond Count: 7
• Topological Polar Surface Area: 223 Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0

Custom Q&A

What is the chemical formula of Dipentamethylenethiuram hexasulfide?

The chemical formula of Dipentamethylenethiuram hexasulfide is C12H20N2S8.

What is the molecular weight of Dipentamethylenethiuram hexasulfide?

The molecular weight of Dipentamethylenethiuram hexasulfide is 448.8 g/mol.

When was the Dipentamethylenethiuram hexasulfide created?

Dipentamethylenethiuram hexasulfide was created on August 8, 2005.

What is the IUPAC Name of Dipentamethylenethiuram hexasulfide?

The IUPAC Name of Dipentamethylenethiuram hexasulfide is (piperidine-1-carbothioylpentasulfanyl) piperidine-1-carbodithioate.

What is the InChIKey of Dipentamethylenethiuram hexasulfide?

The InChIKey of Dipentamethylenethiuram hexasulfide is HPFHYRNETZEPIV-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Dipentamethylenethiuram hexasulfide have?

Dipentamethylenethiuram hexasulfide has 0 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Dipentamethylenethiuram hexasulfide have?

Dipentamethylenethiuram hexasulfide has 8 hydrogen bond acceptor counts.

What is the topological polar surface area of Dipentamethylenethiuram hexasulfide?

The topological polar surface area of Dipentamethylenethiuram hexasulfide is 223 ?2.

How many rotatable bond counts does Dipentamethylenethiuram hexasulfide have?

Dipentamethylenethiuram hexasulfide has 7 rotatable bond counts.

What is the complexity of Dipentamethylenethiuram hexasulfide?

The complexity of Dipentamethylenethiuram hexasulfide is 321.