4,4'-diamino-1,1'-bianthracene-9,9',10,10'-tetrone
fo-519cafc425df26b2
Identity
- Type
- Neutral molecule
- CAS
- 4051-63-2
- EC
- 223-754-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
37- 1,1′-Bianthraquinone, 4,4′-diamino-
- 1,1′-Diamino-4,4′-dianthraquinonyl
- 4,4′-Bis(1-aminoanthraquinone)
- 4,4′-Diamino-1,1′-bianthraquinone
- 4,4′-Diamino-1,1′-dianthraquinone
- 4,4′-Diamino-1,1′-dianthraquinonyl
- 4,4′-Diamino-1,1′-dianthrquinonyl
- 4,4′-Diamino[1,1′-bianthracene]-9,9′,10,10′-tetraone
- 4,4′-Diamino[1,1′-bianthracene]-9,9′,10,10′-tetrone
- [1,1′-Bianthracene]-9,9′,10,10′-tetrone, 4,4′-diamino-
- C.I. Pigment Red 177
- C.I. PR 177
- CAB-LX 471 Red
- CF Red EX 109
- Chromofine Red 6121EC
- Chromofine Red 6125EC
- Chromofine Red 6128EC
- Chromofine Red 6130EC
- Cinilex Red SR 3C
- Cinilex Red SR 4C
- Cromophtal Red A 2B
- Cromophtal Red A 3B
- Dianthraquinonyl red
- Fast Red A 3B
- Fastogen Super Red ATY
- Fastogen Super Red ATY 01
- Fastogen Super Red ATY-TR
- Irgazin Red A 2BN
- Irgazin Red A 2BX
- MG Red K-VC
- Oracet Red BG
- Paliogen Red L 4039
- Paliogen Red L 4045
- Pigment Red 177
- Red A 3B
- Red ATY-TR
- Versal Red A 3B
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KNMQFBWXSICVQC-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C28H16N2O4/c29-19-11-9-13(21-23(19)27(33)17-7-3-1-5-15(17)25(21)31)14-10-12-20(30)24-22(14)26(32)16-6-2-4-8-18(16)28(24)34/h1-12H,29-30H2 |
| IUPAC name chemrof:IUPAC_name | 4,4'-diamino-1,1'-bianthracene-9,9',10,10'-tetrone |
| Molecular formula chemrof:molecular_formula | C28H16N2O4 |
| Molecular mass chemrof:molecular_mass | 444.446 |
| Monoisotopic mass chemrof:monoisotopic_mass | 444.111007 |
| SMILES string chemrof:smiles_string | Nc1ccc(-c2ccc(N)c3c2C(=O)c2ccccc2C3=O)c2c1C(=O)c1ccccc1C2=O |
Known URLs
9Where 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=4051-63-2 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.021.596 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2052079 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL495865 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/66S4IFF43R | enrich_references.pubchem_identifier_url |
| hts.usitc.gov | https://hts.usitc.gov/search?query=3204.17.04.35 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J52.244I | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/77669 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q24688207 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 50ecf57e-88d9-45cf-befe-8ccc8af2a051 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| f4631c4c-9821-4075-8564-1c019f1e446d | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 8a8fd3e8-a13a-4b69-b724-6ce23ffc1276 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7393a2f9-3099-461a-8339-011e7ff6ca75 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4a797bc1-cb4b-4952-9a4c-33d1649d6f3d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 407c9342-333f-47c8-9665-d485cb320cf3 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 0b9be82f-b9ac-401a-9954-45b00737de58 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 24fdca7b-e77a-4efd-8592-38285932c553 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| c9c49646-d09a-4a8e-9160-de3a6819905a | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 43bfca81-636a-4ae0-afd8-cf64e1f82de7 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 1056e542-cbd4-4f0d-9838-120d20e00c1c | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| fd30638b-72dd-4d61-a58e-1b431f5ecfa0 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 46be06eb-9468-4279-b203-ed56b5ae75ac | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (54 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