Bis(2,4,4-trimethylpentyl)peroxyanhydride
fo-38ca4e89aa962456
Identity
- Type
- Neutral molecule
- CAS
- 3851-87-4
- EC
- 223-356-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
8- 3,5,5-Trimethylhexanoyl peroxide
- Bis(3,5,5-trimethyl-1-oxohexyl) peroxide
- Bis(3,5,5-trimethylhexanoyl) peroxide
- Peroxide, bis(3,5,5-trimethyl-1-oxohexyl)
- Peroxide, bis(3,5,5-trimethylhexanoyl)
- Peroyl 355-75 (S)
- Trigonox 36
- Trigonox 36C75
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KFGFVPMRLOQXNB-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C18H34O4/c1-13(11-17(3,4)5)9-15(19)21-22-16(20)10-14(2)12-18(6,7)8/h13-14H,9-12H2,1-8H3 |
| IUPAC name chemrof:IUPAC_name | 3,5,5-Trimethylhexanoyl peroxide |
| Molecular formula chemrof:molecular_formula | C18H34O4 |
| Molecular mass chemrof:molecular_mass | 314.466 |
| Monoisotopic mass chemrof:monoisotopic_mass | 314.24571 |
| SMILES string chemrof:smiles_string | CC(CC(=O)OOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C |
Known URLs
6Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=3851-87-4 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.021.234 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID60863279 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.259I | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/107176 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72514073 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 188a4e0f-1fbe-4a60-8e88-e4ddceef2531 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 6bf3cee6-aa55-4c62-9b6d-e023cb602d7b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 1f352e95-6ab2-4c7a-9cbe-9602db453995 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 81575221-e09c-4bc6-9520-92f2f5947eb0 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ea5ac4d6-b73c-45a8-bfbc-6fab9a303587 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 5e4a2b00-9b72-4407-833c-4b7701b77cab | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| ef418852-8d3c-47cb-a416-97c235c831af | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| d5073622-a292-4980-91f9-3600506e72d6 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| c136a81d-a4c4-47f3-b76a-4ced2c1cec6d | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 7ae047a3-0456-4643-b406-d93bba44701d | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| f4287be4-d487-45f7-9ca0-d7364e2ebe5c | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| b692bb5a-07c6-4711-9665-c6fb169106ca | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| fb0a0792-6838-4138-8fa4-60378c50ccb6 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works