O,O,O',O'-tetrapropyl Pyrophosphorothioate
fo-b825b3dbc181863b
Identity
- Type
- Neutral molecule
- CAS
- 3244-90-4
- EC
- 221-817-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 60 across every transformer
Structure
Alternative labels
8- Aspon
- O,O,O,O-Tetrapropyl dithiopyrophosphate
- Propyl thiopyrophosphate ([(PrO)2P(S)]2O)
- Tetra-n-propyl dithionopyrophosphate
- Tetra-n-propyl dithiopyrophosphate
- Thiodiphosphoric acid ([(HO)2P(S)]2O), OP,OP,OP′,OP′-tetrapropyl ester
- Thiodiphosphoric acid ([(HO)2P(S)]2O), tetrapropyl ester
- Thiopyrophosphoric acid ([(HO)2PS]2O), tetrapropyl ester
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | IIDFEIDMIKSJSV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H28O5P2S2/c1-5-9-13-18(20,14-10-6-2)17-19(21,15-11-7-3)16-12-8-4/h5-12H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | O,O,O,O-Tetrapropyl dithiopyrophosphate |
| Molecular formula chemrof:molecular_formula | C12H28O5P2S2 |
| Molecular mass chemrof:molecular_mass | 378.433 |
| Monoisotopic mass chemrof:monoisotopic_mass | 378.085339 |
| SMILES string chemrof:smiles_string | CCCOP(=S)(OCCC)OP(=S)(OCCC)OCCC |
Known URLs
8Where 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=3244-90-4 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.019.834 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6032510 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2550 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/PC55IL137P | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.697J | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/18609 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27286471 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 1e92f73c-82eb-45a2-99fa-52d12ce20647 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 9d1efe92-7db8-44c9-8e38-1b97495a7e8c | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 8f2b76e8-68e4-46ae-a68c-e3d4b4e0d209 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 0852fd48-7a7e-4e50-b67a-1fd0606da841 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| c6f7446d-684c-4bf9-9307-cbf17e41be65 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 32c7ff03-f18c-4818-9f81-95a56238be2e | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| ca1026ec-6911-47d5-9a39-b0e2f54340a1 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| cbb5e7f9-52af-4d2c-b356-126d8df7dfe3 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 0a6fd4c1324077f8f68e87443cda16855406d03b | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 152f8f2e-f9a2-4e10-954c-47c3f0fcfd4f | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 442510c6-df6d-4758-9cf0-eff95ac513ad | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| efa41eb6-1ce6-4bc0-9504-413c45ca7391 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| e43a9ffc-4150-4532-a8ee-f755bec1d3e5 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 5e01d111-161e-448f-b606-809fa0ab9594 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (60 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