2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate
fo-e335525b28f91305
Identity
- Type
- Neutral molecule
- CAS
- 10584-98-2
- EC
- 234-186-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
9- 2-Ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecanoate
- 8-Oxa-3,5-dithia-4-stannatetradecanoic acid, 4,4-dibutyl-10-ethyl-7-oxo-, 2-ethylhexyl ester
- Acetic acid, [(dibutylstannylene)dithio]di-, bis(2-ethylhexyl) ester
- Di-n-butyltin bis(2-ethylhexylmercaptoacetate)
- Dibutyltin bis(2-ethylhexyl mercaptoacetate)
- Dibutyltin bis(2-ethylhexyl thioglycolate)
- Mellite 31
- Tin, dibutylbis[(carboxymethyl)thio]-, bis(2-ethylhexyl) ester
- Tinstab BTS 71S
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | PRIUALOJYOZZOJ-UHFFFAOYSA-L |
| InChI2D string chemrof:inchi2d_string | InChI=1S/2C10H20O2S.2C4H9.Sn/c2*1-3-5-6-9(4-2)7-12-10(11)8-13;2*1-3-4-2;/h2*9,13H,3-8H2,1-2H3;2*1,3-4H2,2H3;/q;;;;+2/p-2 |
| IUPAC name chemrof:IUPAC_name | 2-ethylhexyl 4,4-dibutyl-10-ethyl-7-oxo-8-oxa-3,5-dithia-4-stannatetradecan-1-oate |
| Molecular formula chemrof:molecular_formula | C28H56O4S2Sn |
| Molecular mass chemrof:molecular_mass | 639.597 |
| Monoisotopic mass chemrof:monoisotopic_mass | 640.264197 |
| SMILES string chemrof:smiles_string | CCCCC(CC)COC(=O)C[S][Sn]([CH2]CCC)([CH2]CCC)[S]CC(=O)OCC(CC)CCCC |
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=10584-98-2 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.031.066 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0029719 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2CLF5X93VN | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.298E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/101586614 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/9571022 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27254563 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3489c7da-bae4-4dae-a65d-2657965e4b4f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 217aa008-bbec-4dd7-8759-3f1836526482 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 5b95cfeb-cbed-45c9-8c4b-8f2669679ef2 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| cd215334-8884-42e4-9d89-64684f5716b3 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| fb431a8e-cae8-42ca-a944-010ef9aa44ad | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 97a4aef0-5fd0-4e1d-b4b9-4e5238966f3f | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 420588d3-2285-4475-aab1-5a5784427c2e | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| fb1874f0-c03b-459e-a014-14a101eb88ab | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| ef467b2a-479f-446a-82d8-fefccf76213e | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 51b7ed69-f87d-48b1-bd90-895f9f0938b8 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9006dad0-930c-4b5e-863d-a00905e2a3a3 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 5f3ba249-1eab-4876-89e4-3e4b04c3b2f1 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 4caf74b5-3f0e-4e63-a675-a4437d2baf42 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (54 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