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| CAS No.: | 124252-41-1 |
|---|---|
| Name: | 4-(TRIBUTYLSTANNYL)PYRIDINE |
| Article Data: | 6 |
| Molecular Structure: | |
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|
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| Formula: | C17H31NSn |
| Molecular Weight: | 368.15 |
| Synonyms: | 4-(1,1,1-Tributylstannyl)pyridine;4-(Tri-n-butylstannyl)pyridine;4-(Tributylstannanyl)pyridine;4-Pyridyltributyltin;4-Tributyltinpyridine;Tributyl-4-pyridylstannane; |
| Melting Point: | 243-246 °C |
| Boiling Point: | 377.8 °C at 760 mmHg |
| Flash Point: | 182.3 °C |
| Solubility: | Not miscible in water. Soluble in ether, hexane and tetrahydrofuran. |
| Hazard Symbols: |
 T,  Xi
|
| Risk Codes: | T,Xi:; ">  T,Xi:; |
| Safety: | 36/37/39-45-60-61 |
| PSA: | 12.89000 |
| LogP: | 5.13770 |
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- Total:30 Page 1 of 1 1
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Specification
The 4-(Tributylstannyl)pyridine, with the CAS registry number 124252-41-1, is also known as Tributyl-pyridin-4-yl-stannane. It belongs to the product categories of Organostannes; Pyridine; Tributylstanny. This chemical's molecular formula is C17H31NSn and molecular weight is 368.14. Its IUPAC name is called tributyl(pyridin-4-yl)stannane.
Physical properties of 4-(Tributylstannyl)pyridine: (1)ACD/LogP: 8.53; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.54; (4)ACD/LogD (pH 7.4): 8.48; (5)ACD/BCF (pH 5.5): 184756.27; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 107505.98; (8)ACD/KOC (pH 7.4): 934088.31; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 10; (11)Flash Point: 182.3 °C; (12)Enthalpy of Vaporization: 60.1 kJ/mol; (13)Boiling Point: 377.8 °C at 760 mmHg; (14)Vapour Pressure: 1.43E-05 mmHg at 25°C.
Uses of 4-(Tributylstannyl)pyridine: it can be used to produce 4-phenyl-pyridine at temperature of 110 °C. This reaction will need reagent PdCl2(PPh3)2, LiCl and solvent toluene. The yield is about 44%.
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When you are using this chemical, please be cautious about it as the following:
This chemical that at low levels can cause damage to health. In addition, this chemical may cause inflammation to the skin or other mucous membranes.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCC[Sn](CCCC)(CCCC)C1=CC=NC=C1
(2)InChI: InChI=1S/C5H4N.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h2-5H;3*1,3-4H2,2H3
(3)InChIKey: UNEPXPMBVGDXGH-UHFFFAOYSA-N