Brodifacoum
fo-ed8f405d587aabf3
Identity
- Type
- Neutral molecule
- CAS
- 56073-10-0
- EC
- 259-980-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
11- 2H-1-Benzopyran-2-one, 3-[3-(4′-bromo[1,1′-biphenyl]-4-yl)-1,2,3,4-tetrahydro-1-naphthalenyl]-4-hydroxy-
- 3-[3-(4′-Bromo[1,1′-biphenyl]-4-yl)-1,2,3,4-tetrahydro-1-naphthalenyl]-4-hydroxy-2H-1-benzopyran-2-one
- 4-hydroxy-3-(3-(4'-bromo-4-biphenylyl)-1,2,3,4-tetrahydro-1-naphthyl)coumarin
- BFC
- Brodimat
- Brodimax Forte Pasta
- Klerat
- Klerat Block
- Talon
- Talon (rodenticide)
- Volid
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | VEUZZDOCACZPRY-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C31H23BrO3/c32-24-15-13-20(14-16-24)19-9-11-21(12-10-19)23-17-22-5-1-2-6-25(22)27(18-23)29-30(33)26-7-3-4-8-28(26)35-31(29)34/h1-16,23,27,33H,17-18H2 |
| IUPAC name chemrof:IUPAC_name | 4-hydroxy-3-(3-(4'-bromo-4-biphenylyl)-1,2,3,4-tetrahydro-1-naphthyl)coumarin |
| Molecular formula chemrof:molecular_formula | C31H23BrO3 |
| Molecular mass chemrof:molecular_mass | 523.426 |
| Monoisotopic mass chemrof:monoisotopic_mass | 522.083057, 522.08306 |
| SMILES string chemrof:smiles_string | O=c1oc2ccccc2c(O)c1C1CC(c2ccc(-c3ccc(Br)cc3)cc2)Cc2ccccc21 |
Known URLs
13Where 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=56073-10-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81892 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.054.509 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID5032529 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL233451 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/A25P3CP5S7 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J11.113I | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18694 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18694 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:87 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/54680676 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q421203 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Brodifacoum | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3d38c7cf-fd3a-4327-ac45-361919df10a2 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 85e5bc6a-715a-4468-8738-005db9a3ed3d | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| aa2b9253-362b-441e-b33a-6da3dc8151a7 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| ffbd3b54-3889-4b94-a8e5-5365eb0511f7 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 95adf7c4-9fd5-4cf5-a85b-b99c090321ee | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 3327f2c1-d031-412d-be55-e788f05dc2b9 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| f4015ff3-0ebc-4a85-8059-39aefd497a51 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 524bb5ac-0d71-4428-8e46-3b2920b11f38 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| efd0bab1-b2fb-4143-9ac4-6d379079906b | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| a4dae8ab-ddd4-4563-8a37-3723d786db01 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a5f73bca-2e12-4228-8c15-bdcdf0d352fb | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 4c635bc5-1af9-49b2-b5db-d69582254ce7 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 24d22aab-7155-40e3-9407-db92d2745277 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 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