Basic information
- CAS
22397-33-7- Standard SMILES
CC1(C)CCC(C)(C)OOC(C)(C)OO1- InChIKey
QRIQYQXNFSXNGR-UHFFFAOYSA-N- Molecular formula
- C11H22O4
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.15180918
Names & identifiers
- Preferred name
- 1,2,4,5-Tetroxonane, 3,3,6,6,9,9-hexamethyl-
- IUPAC
- 3,3,6,6,9,9-hexamethyl-1,2,4,5-tetraoxonane
- English name
- 3,3,6,6,9,9-hexamethyl-1,2,4,5-tetroxonane
- Molecular formula
- C11H22O4
- Molecular weight
- 218.29
Names & synonyms
3,3,6,6,9,9-Hexamethyl-1,2,4,5-tetroxonane22397-33-7EINECS 244-954-81,2,4,5-Tetroxonane, 3,3,6,6,9,9-hexamethyl-3,3,6,6,9.9-Hexamethyl-1,2,4,5-tetraoxocyclononaneDTXSID0066791RefChem:71477DTXCID5036682244-954-83,3,6,6,9,9-hexamethyl-1,2,4,5-tetraoxonaneSCHEMBL829843,3,6,6,9,9-hexamethyl 1,2,4,5-tetraoxa cyclononane
Show more names
P-12303,3,6,6,9,9-Hexamethyl-1,2,4,5-tetraoxacyclononane3,3,6,6,9,9-hexamethyl-1,2,4,5-tetroxonane(purity is 52%～100%)3,3,6,6,9,9-hexamethyl-1,2,4,5-tetroxonane[Content ( 48%)]
QRIQYQXNFSXNGR-UHFFFAOYSA-NNS00050251
Database identifiers
- CAS
22397-33-7- PubChem CID
- 89694
- DTXSID
DTXSID0066791- EC Number
- 244-954-8
- Nikkaji
- J61.337A
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Boiling point
- 206.2 · 206.2±20.0 °C(Predicted)
- Density
- 0.913 · 0.913±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 1 · 1,2,4,5-Tetroxonane, 3,3,6,6,9,9-hexamethyl- (22397-33-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
DOT Label
Organic Peroxide Explosive
Organic Peroxide
Organic Peroxide
Fire Hazards
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Health Hazards
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Reactive Group
Peroxides, Organic
Peroxides, Organic
Peroxides, Organic
Reactivity Profile
Peroxides, such as 3,3,6,6,9,9-HEXAMETHYL-1,2,4,5-TETRAOXACYCLONONANE, are good oxidizing agents. Organic compounds can ignite on contact with concentrated peroxides. Strongly reduced material such as sulfides, nitrides, and hydrides may react explosively with peroxides. There are few chemical classes that do not at least produce heat when mixed with peroxides. Many produce explosions or generate gases (toxic and nontoxic). Generally, dilute solutions of peroxides (<70%) are safe, but the presence of a catalyst (often a transition metal such as cobalt, iron, manganese, nickel, or vanadium) as an impurity may even then cause rapid decomposition, a buildup of heat, and even an explosion. Solutions of peroxides often become explosive when evaporated to dryness or near-dryness. Decomposes in contact with many metals and acids (USCG, 1999).
Peroxides, such as 3,3,6,6,9,9-HEXAMETHYL-1,2,4,5-TETRAOXACYCLONONANE, are good oxidizing agents. Organic compounds can ignite on contact with concentrated peroxides. Strongly reduced material such as sulfides, nitrides, and hydrides may react explosively with peroxides. There are few chemical classes that do not at least produce heat when mixed with peroxides. Many produce explosions or generate gases (toxic and nontoxic). Generally, dilute solutions of peroxides (<70%) are safe, but the presence of a catalyst (often a transition metal such as cobalt, iron, manganese, nickel, or vanadium) as an impurity may even then cause rapid decomposition, a buildup of heat, and even an explosion. Solutions of peroxides often become explosive when evaporated to dryness or near-dryness. Decomposes in contact with many metals and acids (USCG, 1999).
Peroxides, such as 3,3,6,6,9,9-HEXAMETHYL-1,2,4,5-TETRAOXACYCLONONANE, are good oxidizing agents. Organic compounds can ignite on contact with concentrated peroxides. Strongly reduced material such as sulfides, nitrides, and hydrides may react explosively with peroxides. There are few chemical classes that do not at least produce heat when mixed with peroxides. Many produce explosions or generate gases (toxic and nontoxic). Generally, dilute solutions of peroxides (<70%) are safe, but the presence of a catalyst (often a transition metal such as cobalt, iron, manganese, nickel, or vanadium) as an impurity may even then cause rapid decomposition, a buildup of heat, and even an explosion. Solutions of peroxides often become explosive when evaporated to dryness or near-dryness. Decomposes in contact with many metals and acids (USCG, 1999).
Air and Water Reactions
No rapid reaction with air. No rapid reaction with water.
No rapid reaction with air. No rapid reaction with water.
No rapid reaction with air. No rapid reaction with water.
Safety & protection
Fire Fighting
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
First Aid
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Nonfire Spill Response
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Isolation and Evacuation
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Personal Protective Equipment (PPE)
Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2,4,5-Tetroxonane, 3,3,6,6,9,9-hexamethyl-: INACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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