Basic information
- CAS
5943-35-1- Standard SMILES
CC(C)(C)SSSSC(C)(C)C- InChIKey
NHHSUCWHDQEHTJ-UHFFFAOYSA-N- Molecular formula
- C8H18S4
- Average molar mass
- 242.5 g/mol
- Monoisotopic mass
- 242.02913527
Names & identifiers
- Preferred name
- Di-tert-butyl tetrasulphide
- IUPAC
- 2-(tert-butyltetrasulfanyl)-2-methylpropane
- English name
- di-tert-butyl tetrasulphide
- Molecular formula
- C8H18S4
- Molecular weight
- 242.48852
Names & synonyms
Di-tert-butyl tetrasulphideEINECS 227-704-2RefChem:586112227-704-25943-35-1di-tert-butyltetrasulfane1,4-Di-tert-butyltetrasulfaneDi-tert.- Butyl-TetrasulfidSCHEMBL628225DTXSID00871151NHHSUCWHDQEHTJ-UHFFFAOYSA-NDB-254565
Show more names
Di-tert-butyl tetrasulfideDi-tert-butyl pertetrasulfideTetrasulfide, bis(1,1-dimethylethyl)
NS00048028
Database identifiers
- CAS
5943-35-1- PubChem CID
- 80047
- DTXSID
DTXSID00871151- EC Number
- 227-704-2
- Nikkaji
- J81.121A
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Melting point
- 1.2 °C · 1.2°C
- Boiling point
- 345.32 °C · 345.32°C (rough estimate)
- Density
- 1.069 · 1.0690
- refractive index
- 1.566 · 1.5660 (estimate)
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
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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