Diflubenzuron
fo-092092c7d3bcca14
Identity
- Type
- Neutral molecule
- CAS
- 35367-38-5
- EC
- 252-529-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
What it is used for
2
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| insecticide CHEBI:24852 | Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
27- 1-(4-chlorophenyl)-3-(2,6-difluorobenzoyl)urea
- 1-(p-chlorophenyl)-3-(2,6-difluorobenzoyl)urea
- AI 3-29054
- Benzamide, N-[[(4-chlorophenyl)amino]carbonyl]-2,6-difluoro-
- difluron
- Dimilin
- Dimilin 25
- Du-Dim
- Duphar PH 60-40
- Larvakil
- MeSH ID: D004132
- Micromite
- Micromite (Uniroyal)
- Minerin
- Mosdop P
- Mosdop TB
- N-(2,6-Difluorobenzoyl)-N′-(4-chlorophenyl)urea
- N-(4-Chlorophenylcarbamoyl)-2,6-difluorobenzamide
- N-(p-Chlorophenyl)-N′-(2,6-difluorobenzoyl)urea
- N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide
- N-[[(4-Chlorophenyl)amino]carbonyl]-2,6-difluorobenzamide
- N-{[(4-chlorophenyl)amino]carbonyl}-2,6-difluorobenzamide
- PH 60-40
- Rotadin
- Sniper (benzoylurea insecticide)
- Suniao-one
- Thompson-Hayward 6040
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | QQQYTWIFVNKMRW-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21) |
| IUPAC name chemrof:IUPAC_name | 1-(4-chlorophenyl)-3-(2,6-difluorobenzoyl)urea |
| Molecular formula chemrof:molecular_formula | C14H9ClF2N2O2 |
| Molecular mass chemrof:molecular_mass | 310.687 |
| Monoisotopic mass chemrof:monoisotopic_mass | 310.03206, 310.032062 |
| SMILES string chemrof:smiles_string | O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(Cl)cc1 |
Known URLs
24Where 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 |
|---|---|---|
| beilstein | beilstein:2162461 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=35367-38-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34703 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.047.740 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.236.637 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1024049 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL49338 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/J76U6ZSI8D | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0031778 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.888K | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C14427 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D07829 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C14427 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D07829 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45091 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:234 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/37123 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3077 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19835689 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20954045 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22782793 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8510122 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q424939 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Diflubenzuron | enrich_references.chebi_xrefs |
Elementary flows
16| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3e4d298d-6556-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9c9e-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9d1aa063-731c-4b2c-be3f-319cf869c6e1 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9c9d-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 08a91e70-3ddc-11dd-9c9f-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9c9c-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9c9a-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9ca3-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| c212a7e2d17c757b89c022d17655ef98741b8b65 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 08a91e70-3ddc-11dd-9c9b-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-9ca1-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 08a91e70-3ddc-11dd-9ca4-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 4a5cb2413d29243b0c374de6be9f32f212058f4d | Environmental → Water → River | agribalyse algorithm addition | kg | 0 |
| 08a91e70-3ddc-11dd-9ca0-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 301251b4e1d8f8e6e751c9046c38dec571fd47bb | Environmental → Water → Unconfined aquifer | ecoinvent algorithm addition | kg | 0 |
| 08a91e70-3ddc-11dd-9ca2-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (58 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