Dioxathion
fo-50f29a84bacc1508
Identity
- Type
- Neutral molecule
- CAS
- 78-34-2
- EC
- 201-107-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
12- 1,4-Dioxan-2,3-diyl bis(O,O-diethyl phosphorothiolothionate)
- 2,3-Bis(diethoxyphosphinothioylthio)-1,4-dioxane
- 2,3-p-Dioxanedithiol S,S-bis(O,O-diethyl phosphorodithioate)
- Delnatex
- Delnav
- Dioxation
- ENT 22,897
- Kavadel
- Navadel
- Phosphorodithioic acid, S,S′-1,4-dioxane-2,3-diyl O,O,O′,O′-tetraethyl ester
- Phosphorodithioic acid, S,S′-p-dioxane-2,3-diyl O,O,O′,O′-tetraethyl ester
- Phosphorodithioic acid, SP,SP′-1,4-dioxane-2,3-diyl OP,OP,OP′,OP′-tetraethyl ester
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | VBKKVDGJXVOLNE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H26O6P2S4/c1-5-15-19(21,16-6-2)23-11-12(14-10-9-13-11)24-20(22,17-7-3)18-8-4/h11-12H,5-10H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | 2,3-Bis(diethoxyphosphinothioylthio)-1,4-dioxane |
| Molecular formula chemrof:molecular_formula | C12H26O6P2S4 |
| Molecular mass chemrof:molecular_mass | 456.55 |
| Monoisotopic mass chemrof:monoisotopic_mass | 456.008746, 456.00875 |
| SMILES string chemrof:smiles_string | CCOP(=S)(OCC)SC1OCCOC1SP(=S)(OCC)OCC |
Known URLs
18Where 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=78-34-2 | enrich_references.chebi_xrefs |
| cdc.gov | https://www.cdc.gov/niosh-rtecs/TE331DF0.html | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81364 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.001.007 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0883 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9020534 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2106286 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/J2DF82JA7N | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.826F | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C17877 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C17877 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C169914 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:1100 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/6531 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3018 | enrich_references.pubchem_identifier_url |
| vsdb | vsdb:1100 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q2779034 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Dioxathion | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| fae18cc2-7857-4e48-966f-ca94718fa8e5 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| c3b50cae-57c9-4a6a-9c3f-960834251a21 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9532fc37-53a6-47d2-81a0-398eb166c4a0 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 4a7cc9b3-b753-47ac-a38a-60809c188f27 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 00c8d4ef-911a-43fb-a885-f55b9dd4e76b | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 0cdbe9a0-4c33-4acc-adad-ddedd853743c | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 2f950d7b-2acb-4ac7-9420-44a0fbcb5919 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 10810706-7ac2-4cd1-a35f-c0130d93c868 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 4a4d4f888ad576b263ef4e5c73bf669c57f8da9a | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 8d6c76fd-1b2a-417b-bcbe-83a66612ad57 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| e728bc67-5d08-439a-a9ce-47950cbb1d25 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 2ae9073f-b95b-418c-89ed-3a53fdad81b1 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 4c1e43e1-7154-48c2-ab31-feb736ebb8fd | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| d7e4a64b-e49e-4ccb-9e05-d3186cd45b78 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (56 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