Tetrabutyltin
fo-1781097a59ca5315
Identity
- Type
- Neutral molecule
- CAS
- 1461-25-2
- EC
- 215-960-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
5- Stannane, tetrabutyl-
- Tetra-n-butylstannane
- Tetra-n-butyltin
- Tetrabutylstannane
- Tetrabutyltin(IV)
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | AFCAKJKUYFLYFK-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/4C4H9.Sn/c4*1-3-4-2;/h4*1,3-4H2,2H3; |
| IUPAC name chemrof:IUPAC_name | Tetrabutyltin |
| Molecular formula chemrof:molecular_formula | C16H36Sn |
| Molecular mass chemrof:molecular_mass | 347.175 |
| Monoisotopic mass chemrof:monoisotopic_mass | 348.183896 |
| SMILES string chemrof:smiles_string | CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC |
Known URLs
13Where 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.
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ea02e2f9-621a-4a51-a944-db98518407e6 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 6c5fcdca-210b-46b4-971a-78b4e374136a | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| bbf6b804-5ccb-4203-9d70-ebca03551341 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 141a26e4-f253-4b9c-a7b7-69b459e4290f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 86de02d6-920b-42fd-959d-a569e9ffc868 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| dd3d59d7-2adf-4108-aea7-e219ff9ff223 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 32bbbd98-1285-4aa9-b7b9-403559f0954a | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 204afd8d-1988-45aa-862b-f34963b1c7a6 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3fae5659-be3f-44a2-8d0a-8a15b3da0740 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| bf92de18-7111-4e5a-bc5c-ac5113f70678 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| d24d8092-ba74-42f0-8634-6d0a12a93f2d | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| adf0b490-8630-476f-92b3-fdabff1abcc6 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| e2556266-85bb-4154-9610-49fe7d454ae5 | 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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