Dibutyl(dimethoxy)stannane
fo-c4f7cc4ea230b21e
Identity
- Type
- Neutral molecule
- CAS
- 1067-55-6
- EC
- 213-935-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
7- Dibutyldimethoxystannane
- Dibutyldimethoxytin
- Dibutyltin dimethoxide
- Dimethoxydibutyltin
- S-Cat 27
- Stannane, dibutyldimethoxy-
- Tin, dibutyldimethoxy-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | ZXDVQYBUEVYUCG-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/2C4H9.2CH3O.Sn/c2*1-3-4-2;2*1-2;/h2*1,3-4H2,2H3;2*1H3;/q;;2*-1;+2 |
| IUPAC name chemrof:IUPAC_name | Dibutyl(dimethoxy)stannane |
| Molecular formula chemrof:molecular_formula | C10H24O2Sn |
| Molecular mass chemrof:molecular_mass | 295.011 |
| Monoisotopic mass chemrof:monoisotopic_mass | 296.079825 |
| SMILES string chemrof:smiles_string | CCC[CH2][Sn]([CH2]CCC)([O]C)[O]C |
Known URLs
10Where 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=1067-55-6 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.012.669 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1061441 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=101695 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/OC0TV05L8M | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J80.059G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/102248374 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/16049892 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/16683107 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27895419 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| b0472da1-07fe-497b-bf8e-bcd4d617382d | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| f9bd0a5c-4a3e-4ae8-a494-2c7074f84488 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 0afd37b5-078e-422f-9be6-c5ab8158bf27 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| c07152e4-aae1-4631-a6af-2aeb98feb8dc | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 9d6283e5-628b-4265-ac3a-339c7dee5f63 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| cb32fee9-8339-4270-a551-a8ba5710e091 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| a41298b0-2df5-4072-a64a-e81ace9a4f38 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 465e1af7-bb99-41e9-bf28-eed2ac1fe171 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 8681631a-5ded-4686-976b-02d3db13a923 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 2c3a47b2-2610-40d7-bb09-927fb83392fd | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| c4d0211d-bed3-4490-82a2-9d2f9fb12c3b | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| cf07d55b-bed6-4585-ad92-ffd601592e70 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 715ba9eb-a7da-4aaf-9487-e8769324679f | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 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