N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide
fo-165405fc8230ff3a
Identity
- Type
- Neutral molecule
- CAS
- 15993-42-7
- EC
- 240-131-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
7- Butanamide, N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)azo]-3-oxo-
- Butanamide, N-(5-chloro-2-methoxyphenyl)-2-[2-(2-methoxy-4-nitrophenyl)diazenyl]-3-oxo-
- C.I. Pigment Yellow 111
- Irgalite Yellow F 4G
- N-(5-Chloro-2-methoxyphenyl)-2-[2-(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide
- o-Acetoacetanisidide, 5′-chloro-2-[(2-methoxy-4-nitrophenyl)azo]-
- Pigment Yellow 111
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | AYOFXUHULUCJBF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C18H17ClN4O6/c1-10(24)17(18(25)20-14-8-11(19)4-7-15(14)28-2)22-21-13-6-5-12(23(26)27)9-16(13)29-3/h4-9,17H,1-3H3,(H,20,25) |
| IUPAC name chemrof:IUPAC_name | N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide |
| Molecular formula chemrof:molecular_formula | C18H17ClN4O6 |
| Molecular mass chemrof:molecular_mass | 420.809 |
| Monoisotopic mass chemrof:monoisotopic_mass | 420.083662 |
| SMILES string chemrof:smiles_string | COc1cc([N+](=O)[O-])ccc1N=NC(C(C)=O)C(=O)Nc1cc(Cl)ccc1OC |
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=15993-42-7 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.036.467 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.129.440 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID90864653 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/26W64U012B | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J219.929G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/85940 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q126616027 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q27254128 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| b36518eb-eb8a-48c8-8883-40be79c78e8d | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 2520a35e-577a-48ff-9f68-fdc6b6fcb83b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| bb9ad9bc-f0b1-4ffd-be11-ad7d808ae463 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 1f7abe28-5203-47d3-b17e-248adb03569d | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 682c9f55-e440-498d-8609-b02ce7430643 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 915f453e-ed22-49d8-a4af-4f48ef1fc6b3 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 643cf780-0963-4852-b473-a34c4188aa88 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 11cc7ddf-b463-4ead-ad21-f642e52cf41b | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| b42f5e26-0e5c-40e5-89d6-bbc1006d1dac | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| c471cfcb-2612-41fc-9360-3fde67901366 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 77b4d588-2d31-4dfd-a0b3-f2f7e2d8b2e6 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 3972ee7f-cbec-42f2-8ec8-2b40c9de013f | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| f87e9c8a-48b1-469a-bbbb-b6021fb22c53 | 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