3,6-bis(4-tert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione/n
fo-df666b4194689ebe
Identity
- Type
- Neutral molecule
- CAS
- 84632-59-7
- EC
- 416-250-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
17- 1,4-Diketo-3,6-bis(4-tert-butylphenyl)pyrrolo[3,4-c]pyrrole
- 3,6-Bis(4-(tert-butyl)phenyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione
- 3,6-Bis(4-tert-butylphenyl)-1,4-diketopyrrolo[3,4-c]pyrrole
- 3,6-Bis(4-tert-butylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione
- 3,6-Bis[4-(1,1-dimethylethyl)phenyl]-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione
- C.I. Pigment Orange 73
- Cinilex DPP Orange SJ 1C
- DPP Orange RA
- DPP Orange SJ 1C
- Irgazin DPP Orange RA
- Irgazin Orange EH 1287
- Irgazin Orange L 2990HD
- Permanent Orange 3RTN-P
- Pigment Orange 16A
- Pigment Orange 73
- Pyrrolo[3,4-c]pyrrole-1,4-dione, 3,6-bis[4-(1,1-dimethylethyl)phenyl]-2,5-dihydro-
- Xianlite Orange EI 4500
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | LUWZMQBKBJUDAU-UHFFFAOYSA-N, WKDXGFAVUSYQON-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C26H28N2O2/c1-25(2,3)17-11-7-15(8-12-17)21-19-20(24(30)27-21)22(28-23(19)29)16-9-13-18(14-10-16)26(4,5)6/h7-14H,1-6H3,(H,27,30)(H,28,29) |
| IUPAC name chemrof:IUPAC_name | 3,6-Bis(4-(tert-butyl)phenyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione |
| Molecular formula chemrof:molecular_formula | C26H28N2O2 |
| SMILES string chemrof:smiles_string | CC(C)(C)c1ccc(C2=C3C(=O)NC(c4ccc(C(C)(C)C)cc4)=C3C(=O)N2)cc1 |
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=84632-59-7 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.111.181 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID601020021 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.018.062G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/135739860 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q26706177 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| c347065e-dfb2-4e45-95af-ee70177b7085 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| f20bef92-3027-4583-ad8a-aa13d8f7fe1e | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 15629ce7-cfd6-4142-996b-d598282607fe | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 81c573eb-a9d7-4f9a-85fd-cdf75411bc4f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 966dba6b-6573-4a8d-9e5f-e646bdcc8abe | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 2b527ed9-5ca7-4df4-a551-c9d6b5840942 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 47c32760-ced5-4942-93d7-14d3059427c1 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| d4d2fbd9-fec8-4db7-b1df-2340c2f63246 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 887b8734-169a-4127-9215-0f1034c998f5 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 8fbd7a57-cc4d-454f-b4f7-bcef70c2e051 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 6edd5f38-db6a-4041-b8de-8444965612e3 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 003a9d31-4e37-4ab0-956e-e911aec195aa | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| e647be10-9286-40a0-8d2f-6badce8f812a | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
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"@id": "https://commonchemistry.cas.org/detail?cas_rn=84632-59-7"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"416-250-2"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=416-250-2"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}
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