2-[(2-methoxy-5-nitrophenyl)diazenyl]-n-(2-methoxyphenyl)-3-oxobutanamide
fo-850c52c90d4a9bb1
Identity
- Type
- Neutral molecule
- CAS
- 80675-49-6
- EC
- 617-143-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
3- 2-[2-(2-Methoxy-5-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide
- Butanamide, 2-[(2-methoxy-5-nitrophenyl)azo]-N-(2-methoxyphenyl)-3-oxo-
- Butanamide, 2-[2-(2-methoxy-5-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxo-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | OQWQAIRBZGBTBN-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C18H18N4O6/c1-11(23)17(18(24)19-13-6-4-5-7-15(13)27-2)21-20-14-10-12(22(25)26)8-9-16(14)28-3/h4-10,17H,1-3H3,(H,19,24) |
| IUPAC name chemrof:IUPAC_name | 2-[2-(2-Methoxy-5-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide |
| Molecular formula chemrof:molecular_formula | C18H18N4O6 |
| Molecular mass chemrof:molecular_mass | 386.364 |
| Monoisotopic mass chemrof:monoisotopic_mass | 386.122634 |
| SMILES string chemrof:smiles_string | COc1ccc([N+](=O)[O-])cc1N=NC(C(C)=O)C(=O)Nc1ccccc1OC |
Known URLs
4Where 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=80675-49-6 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID201020936 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.783.182F | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/102295954 | enrich_references.pubchem_compound |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| c6eed4a9-12f9-4bf9-a519-ee75c8e28079 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 4e776af2-cf5e-4904-9212-62cbad5da18b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 85b6b6df-e8ec-40c9-a6bc-ff6fa893553b | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| a3338d20-c534-4bfa-a4cf-2e23f37b858c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 6332212b-72e3-4416-95be-ca4398c6536b | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 27f082c7-f70c-48fc-a6fd-e8f696084920 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| fd668a9a-66fd-4338-9917-8d9a2c856f94 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| d7ba08b6-2931-445e-882f-5d454fd719ea | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| c8723dee-36a9-483b-ba88-89f0c98335b4 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| e6bc8545-3466-47e4-88ba-e682fb3efdb5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 4779bfca-5bc2-4296-ac3f-f0d9726dec2a | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 8f4d974b-347c-4be5-8425-63af98fb126f | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 1573db58-003f-45c4-8f9d-62e669c71d00 | 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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