Phenopylate
fo-630edb3736e2cfb3
Identity
- Type
- Neutral molecule
- CAS
- 40575-34-6
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
2- 1-Pyrrolidinecarboxylic acid, 2,4-dichlorophenyl ester
- 2,4-Dichlorophenyl 1-pyrrolidinecarboxylate
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | WKMRIBJBDSRIMJ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C11H11Cl2NO2/c12-8-3-4-10(9(13)7-8)16-11(15)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2 |
| IUPAC name chemrof:IUPAC_name | 1-Pyrrolidinecarboxylic acid, 2,4-dichlorophenyl ester |
| Molecular formula chemrof:molecular_formula | C11H11Cl2NO2 |
| Molecular mass chemrof:molecular_mass | 260.12 |
| Monoisotopic mass chemrof:monoisotopic_mass | 259.016684 |
| SMILES string chemrof:smiles_string | O=C(Oc1ccc(Cl)cc1Cl)N1CCCC1 |
Known URLs
6Where 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=40575-34-6 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID60876304 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2270221 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J18.953G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/92317 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q82857916 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 85006391-898a-4373-8031-31b001166ef9 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 6c821695-ef91-4efc-8131-2516aef26742 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 04bbc698-4e00-49cd-a6c2-d643733d0a41 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| d17a2e61-9e45-4fa5-844f-544245ad6a86 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5b744d39-b238-44f8-b897-f55a33e99fcf | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 9c3c9068-dd1e-4b27-9feb-a063f596e3ae | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 21001ccd-86f7-4813-8c51-065348caa578 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 2260e9d7-9346-4192-b392-f9e131a11bbb | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| aa4b1fef-280e-41d4-a2bd-ce03973e0164 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 01c1050c-fd25-42b4-9cf3-e2bd7eab6d7a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 1aa4de50-42d8-4f04-a36c-b55a6bebce5e | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 1ee5c5d1-16a4-46b1-9745-82c3892a8f65 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 411e9b23-ece6-4dde-9e39-909c4357552d | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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Something wrong here?
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- This is not that chemical
- This record is two substances, or it is a second copy of one
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