3,3'-{(2-chloro-5-methyl-1,4-phenylene)bis[imino(1,3-dioxobutane-2,1-diyl)diazene-2,1-diyl]}bis{4-chloro-n-[2-(4-chlorophenoxy)-5-(trifluoromethyl)phenyl]benzamide}
fo-1dd39f1c07f0863a
Identity
- Type
- Neutral molecule
- CAS
- 79953-85-8
- EC
- 279-356-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
17- 3,3′-[(2-Chloro-5-methyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)-2,1-diazenediyl]]bis[4-chloro-N-[2-(4-chlorophenoxy)-5-(trifluoromethyl)phenyl]benzamide]
- Benzamide, 3,3′-[(2-chloro-5-methyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)-2,1-diazenediyl]]bis[4-chloro-N-[2-(4-chlorophenoxy)-5-(trifluoromethyl)phenyl]-
- Benzamide, 3,3′-[(2-chloro-5-methyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis[4-chloro-N-[2-(4-chlorophenoxy)-5-(trifluoromethyl)phenyl]-
- C.I. Pigment Yellow 128
- Cromophtal Jet Yellow 8GT
- Cromophtal Yellow 8G
- Cromophtal Yellow 8G-CF
- Cromophtal Yellow 8GN
- Cromophtal Yellow 8GNP
- Cromophtal Yellow 8GT
- Cromophtal Yellow K 0990
- Diazo Yellow 8GN
- Diazo Yellow GG
- Fast Yellow 8G
- Irgaphor Yellow 8G-CF
- Pigment Yellow 128
- Yellow 8G-CF(K 01)
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | VOCMTGRPDQPZFA-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C55H37Cl5F6N8O8/c1-26-20-41(68-53(80)49(28(3)76)74-72-43-22-30(5-17-38(43)59)51(78)70-45-24-32(55(64,65)66)7-19-47(45)82-36-14-10-34(57)11-15-36)39(60)25-40(26)67-52(79)48(27(2)75)73-71-42-21-29(4-16-37(42)58)50(77)69-44-23-31(54(61,62)63)6-18-46(44)81-35-12-8-33(56)9-13-35/h4-25,48-49H,1-3H3,(H,67,79)(H,68,80)(H,69,77)(H,70,78) |
| IUPAC name chemrof:IUPAC_name | 3,3′-[(2-Chloro-5-methyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)-2,1-diazenediyl]]bis[4-chloro-N-[2-(4-chlorophenoxy)-5-(trifluoromethyl)phenyl]benzamide] |
| Molecular formula chemrof:molecular_formula | C55H37Cl5F6N8O8 |
| Molecular mass chemrof:molecular_mass | 1229.202 |
| Monoisotopic mass chemrof:monoisotopic_mass | 1226.108118 |
| SMILES string chemrof:smiles_string | CC(=O)C(N=Nc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2Oc2ccc(Cl)cc2)ccc1Cl)C(=O)Nc1cc(Cl)c(NC(=O)C(N=Nc2cc(C(=O)Nc3cc(C(F)(F)F)ccc3Oc3ccc(Cl)cc3)ccc2Cl)C(C)=O)cc1C |
Known URLs
7Where 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=79953-85-8 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.072.120 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.127.377 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID50888572 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J320.210K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/16131214 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72499760 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| aa364ead-25d3-4d56-809a-1526bd22472c | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 822b6130-f0a3-4b40-97a3-a5c614adef50 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| ce3a06b2-08a2-4bf1-938f-7bc3ad3d3e05 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 5bb216f5-5e49-4bbc-b2b6-3b5419118ec9 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| c46769b9-ec75-43db-b450-5dbd855f2d64 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| bde031f0-0120-4a3b-a3a9-9f961ea3c683 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 642aa2bd-3a96-4e3a-8792-dfdcce4a93c3 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 5929e194-a173-4ccc-926b-9478aab811a0 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 7d69d608-ef96-4d37-9a03-6fd52b234a97 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 7108450c-6ee2-43b5-8a03-1e256824932c | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| e4090a40-ca89-41a8-8f2f-ea6d4b0605c8 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 233e611d-a715-4a67-b906-11c8d5603102 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 929fa949-419d-4945-9b28-b38163f6a179 | 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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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