Dipentamethylenethiuram hexasulfide
Basic information
- CAS
971-15-3- Standard SMILES
S=C(SSSSSSC(=S)N1CCCCC1)N1CCCCC1- InChIKey
HPFHYRNETZEPIV-UHFFFAOYSA-N- Molecular formula
- C12H20N2S8
- Average molar mass
- 448.8 g/mol
- Monoisotopic mass
- 447.939218
Names & identifiers
- Preferred name
- Dipentamethylenethiuram hexasulfide
- IUPAC
- (piperidine-1-carbothioylpentasulfanyl) piperidine-1-carbodithioate
- English name
- Dipentamethylenethiuram hexasulfide
- Molecular formula
- C12H20N2S8
- Molecular weight
- 448.82
Names & synonyms
Dipentamethylenethiuram hexasulfide971-15-3Bis(piperidinothiocarbonyl) hexasulphideHexasulfide, bis(1-piperidinylthioxomethyl)Hexasulfide, bis(piperidinothiocarbonyl)Piperidine, 1,1'-(hexathiodicarbonothioyl)bis-ESX7OZN94XEINECS 213-537-2Bis(piperidinothiocarbonyl) hexasulfideRHENOGRAN DPTT 70EC 213-537-2DIPENTAMETHYLENETHIURAM HEXASULPHIDE
Show more names
SULFADSDPTT（DPTH）SULFADS RODFORMAccelerator DPTT TRAHexamethylenebisthiuramhexasulfidebis-(piperidine-1-thiocarbonyl)-hexasulfaneBis[piperidinocarbonothioyl] perhexasulfide
RefChem:588793213-537-21,6-hexasulfanediylbis(1-piperidinylmethanethione)DTXSID4020535(piperidine-1-carbothioylpentasulfanyl) piperidine-1-carbodithioateBis(1-piperidinylthioxomethyl)hexasulfideMFCD00053587Dipentamethylenethiuram hexasulfide(DPTT)
Database identifiers
- CAS
971-15-3- PubChem CID
- 70414
- DTXSID
DTXSID4020535- ChEMBL
CHEMBL3187085- UNII
- ESX7OZN94X
- EC Number
- 213-537-2
- Nikkaji
- J34.436B
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 222 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 321
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionLarge Crystals; Dry Powder
Physicochemical properties
- Melting point
- 135 · 135-136 °C
- Boiling point
- 578.4 · 578.4±33.0 °C(Predicted)
- Density
- 1.518 · 1.518±0.06 g/cm3(Predicted)
- vapor pressure
- 0 Pa · 0Pa at 25℃
- pka
- 0.84 · 0.84±0.20(Predicted)
- Water Solubility
- 10.48 μg/L · 10.48μg/L at 20℃
- LogP
- 6.2 at · 6.2 at 20℃
- Indirect Additives used in Food Contact Substances
- DIPENTAMETHYLENETHIURAM HEXASULFIDE
- CAS DataBase Reference
- 971 · 971-15-3
- FDA 21 CFR
- 177.26 · 177.2600
- FDA UNII
- 7 OZN94X · ESX7OZN94X
- EPA Substance Registry System
- Bis(piperidinothiocarbonyl) hexasulfide (971-15-3)
- Hazard statements
- 413 · H413
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 78.3% (198 of 253) of all reports.
H413 (19.4%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 253 reports by companies from 5 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Piperidine, 1,1'-(hexathiodicarbonothioyl)bis-
Hexasulfide, bis(1-piperidinylthioxomethyl) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexasulfide, bis(1-piperidinylthioxomethyl) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: Bis(piperidinothiocarbonyl) hexasulphide (EC: 213-537-2)
Piperidine, 1,1'-(hexathiodicarbonothioyl)bis-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAquatic Chronic 4 (19.4%)
Safety data
- tsca
- TSCA listed
- Hazard statements
- H413
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 250,000 - <400,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Rubber Product Manufacturing
Hexasulfide, bis(1-piperidinylthioxomethyl): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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