3,6-diphenyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione
fo-6f16eabccc69b325
Identity
- Type
- Neutral molecule
- CAS
- 54660-00-3
- EC
- 402-400-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 53 across every transformer
Structure
This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.
Alternative labels
21- 1,4-Diketo-3,6-diphenyl-pyrrolo-[3,4-c]-pyrrole
- 1,4-Diketo-3,6-diphenylpyrrolo[3,4-c]pyrrole
- 1,4-Dioxo-3,6-diphenylpyrrolo[3,4-c]pyrrole
- 1,4-Diphenyl-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione
- 2,5-Dihydro-3,6-diphenyl-1,4-diketopyrrolo[3,4-c]pyrrole
- 2,5-Dihydro-3,6-diphenylpyrrolo[3,4-c]pyrrole-1,4-dione
- 3,6-Diphenyl-1,4-diketopyrrolo[3,4-c]pyrrole
- 3,6-Diphenyl-1,4-pyrrolo[3,4-c]pyrroledione
- 3,6-Diphenylpyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione
- C.I. Pigment Red 255
- C.I. PR 255
- Cromophtal Coral Red C
- Cromophtal DPP Coral Red C
- DPP Scarlet 5G
- Irgazin DPP Red 5G
- Irgazin DPP Scarlet EK
- Irgazin Red L 3551HD
- Irgazin Scarlet EK
- Irgazin Scarlet L 3550HD
- Pigment Red 255
- Pyrrolo[3,4-c]pyrrole-1,4-dione, 2,5-dihydro-3,6-diphenyl-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KKLJFKIBTOBVJI-UHFFFAOYSA-N, NRFGZRDKOOBNDN-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C18H12N2O2/c21-17-13-14(16(20-17)12-9-5-2-6-10-12)18(22)19-15(13)11-7-3-1-4-8-11/h1-10,15H,(H,19,22), InChI=1S/C18H12N2O2/c21-17-13-14(16(20-17)12-9-5-2-6-10-12)18(22)19-15(13)11-7-3-1-4-8-11/h1-10,19,22H |
| IUPAC name chemrof:IUPAC_name | 1,4-diphenyl-1,2-dihydropyrrolo[3,4-c]pyrrole-3,6-dione, 1,4-diphenyl-1,2-dihydropyrrolo[3,4-c]pyrrole-3,6-quinone, 3-hydroxy-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-6-one, 3-oxidanyl-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-6-one |
| Molecular formula chemrof:molecular_formula | C18H12N2O2 |
| SMILES string chemrof:smiles_string | C1=CC=C(C=C1)C2=C3C(=C(N2)O)C(=NC3=O)C4=CC=CC=C4, C1=CC=C(C=C1)C2C3=C(C(=NC3=O)C4=CC=CC=C4)C(=O)N2 |
Known URLs
8Where 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=54660-00-3 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.132.405 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2068971 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5QGL2U8KQA | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J134.967H | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/141029345 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/625613 | enrich_references.pubchem_compound |
| wikidata.org | https://www.wikidata.org/wiki/Q126601494 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 8da93eb9-cd58-4c44-8aee-a828804bac44 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 22d08d06-0707-4ceb-8892-758d4948fa8f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 313fffa4-70c9-4ec7-881f-1df94eb8ad10 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| e77fc69c-0312-4a9d-9cee-43ad5a4b80cb | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 812502e8-3fe8-45db-8c44-67f7903d11f0 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 2f0de0c8-2993-46e3-8689-ac9118fdf4aa | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 1d8cf3a6-0e59-436d-b8c4-7b5a11a66d85 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 88e3a1b2-2cb7-4685-a3ca-cef5e6ca39fc | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 10d79202-aa90-4f55-9b2e-1c8c2982733d | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| d2f7b45e-f7e5-45b1-a73b-f819ad2d6c21 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| e8b8cce1-1489-4313-9744-02f09d8d30b5 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| c2a84d55-9190-409c-a839-1f11cafb42d7 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 55efc954-1ff2-4726-8594-34b34a81df9c | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (53 changes)
Full record
Flow object JSON
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