Octachlorostyrene
fo-92baf749fd6b5dc5
Identity
- Type
- Neutral molecule
- CAS
- 29082-74-4
- EC
- 684-175-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
8- 1,2,3,4,5-Pentachloro-6-(1,2,2-trichloroethenyl)benzene
- 1,2,3,4,5-pentachloro-6-(trichloroethenyl)benzene
- Benzene, 1,2,3,4,5-pentachloro-6-(1,2,2-trichloroethenyl)-
- Benzene, pentachloro(trichloroethenyl)-
- Octachlorostyrol
- Perchlorostyrene
- Styrene, octachloro-
- Trichlorovinylpentachlorobenzene
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | RUYUCCQRWINUHE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8Cl8/c9-2-1(4(11)8(15)16)3(10)6(13)7(14)5(2)12 |
| IUPAC name chemrof:IUPAC_name | Octachlorostyrene |
| Molecular formula chemrof:molecular_formula | C8Cl8 |
| Molecular mass chemrof:molecular_mass | 379.712 |
| Monoisotopic mass chemrof:monoisotopic_mass | 375.75082, 375.750821 |
| SMILES string chemrof:smiles_string | ClC(Cl)=C(Cl)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl |
Known URLs
11Where 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=29082-74-4 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81542 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.209.644 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2021074 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/304368U4VH | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0255891 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J596.887I | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18148 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18148 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/34466 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27155456 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 87eccaed-8814-4915-a564-0444287577f3 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| 15303078-5e13-4114-a6cc-3106b5f83b6f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 17501711-32ca-40a7-8143-fa3b4011e369 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| a4256662-6744-4265-b5f8-aaa6d4206a1f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| d512acb3-3117-4ed9-ba68-cb2b6a5580cb | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| d14804fb-2822-4e74-8b0c-f2c9fae1082c | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| ada8e754-9619-45ff-843a-d3b9f0f19b3f | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| cc1f7c32-3030-494c-b031-dbac09178e9a | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| 2f495e2d-a067-499b-b801-b4a6d91f030b | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| e975f71b-4e09-49d6-a84c-7bce17be1014 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| cd42e47a-a308-409d-968d-e8bf7fd73248 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| 792cfd66-0f16-4409-8947-8782d36b87bc | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| f18b63c2-80bd-41f1-9e0f-99b6afcf33d7 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=684-175-4"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}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