2-(TRIBUTYLSTANNYL)PYRIDINE

The CAS register number of Pyridine,2-(tributylstannyl)- is 17997-47-6. It also can be called as (2-Pyridinyl)tributylstannane and the systematic name about this chemical is 2-(tributylstannanyl)pyridine. The molecular formula about this chemical is C₁₇H₃₁NSn and the molecular weight is 368.14. It belongs to the following product categories which include Pyridines; Organostannes; Pyridine; Tributylstanny; Classes of Metal Compounds; Sn (Tin) Compounds; Typical Metal Compounds; Organometallic Reagents; Organotin; Organotins and so on.

Physical properties about Pyridine,2-(tributylstannyl)- are: (1)ACD/LogP: 8.53; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.35; (4)ACD/LogD (pH 7.4): 8.53; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 689015.81; (8)ACD/KOC (pH 7.4): 1032191.06; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 10; (11)Polar Surface Area: 12.89 Å²; (12)Flash Point: 182.3 °C; (13)Enthalpy of Vaporization: 60.1 kJ/mol; (14)Boiling Point: 377.8 °C at 760 mmHg; (15)Vapour Pressure: 1.43E-05 mmHg at 25 °C.

Uses of Pyridine,2-(tributylstannyl)-: it can be used to produce 2-(2-nitro-phenyl)-pyridine with 1-iodo-2-nitro-benzene. This reaction will need catalytic agent PdCl₂(PPh₃)₂ and solvent tetrahydrofuran. The reaction time is 24 hour(s) with reaction temperature of 110 °C. The yield is about 75%.

When you are using this chemical, please be cautious about it as the following:
This chemical is flammable. It is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. It is also harmful in contact with skin. It must be through a safe way to dispose of this material and its container as hazardous waste.  If you want to use this chemical, refer to special instructions / safety data sheets, wear suitable protective clothing, gloves and eye face protection. When you are using it, avoid release to the environment. It is irritating to eyes and skin and danger of serious damage to health by prolonged exposure. It is toxic by inhalation and if swallowed. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: n1c(cccc1)[Sn](CCCC)(CCCC)CCCC
(2)InChI: InChI=1/C5H4N.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3;/rC17H31NSn/c1-4-7-14-19(15-8-5-2,16-9-6-3)17-12-10-11-13-18-17/h10-13H,4-9,14-16H2,1-3H3
(3)InChIKey: GYUURHMITDQTRU-XZEWYYMRAI
(4)Std. InChI: InChI=1S/C5H4N.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3
(5)Std. InChIKey: GYUURHMITDQTRU-UHFFFAOYSA-N