Thiourea,N-2-pyridinyl- (14294-11-2)

This chemical is called 1-Pyridin-2-ylthiourea, and it can also be named as Thiourea, N-2-pyridinyl-. With the molecular formula of C₆H₇N₃S, its molecular weight is 153.20. The CAS registry number of this chemical is 14294-11-2, and its product category is Pyridine. Moreover, this chemical should be kept in the sealed place, and it should be dry at normal temperature.

Other characteristics of the 1-Pyridin-2-ylthiourea can be summarised as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/LogD (pH 5.5): -0.78; (3)ACD/LogD (pH 7.4): -0.76; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 10.63; (7)ACD/KOC (pH 7.4): 10.95; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 51.46 Ų; (12)Index of Refraction: 1.742; (13)Molar Refractivity: 44.77 cm³; (14)Molar Volume: 110.7 cm³; (15)Polarizability: 17.75×10^-24cm³; (16)Surface Tension: 84.5 dyne/cm; (17)Density: 1.382 g/cm³; (18)Flash Point: 134.4 °C; (19)Enthalpy of Vaporization: 53.86 kJ/mol; (20)Boiling Point: 298.7 °C at 760 mmHg; (21)Vapour Pressure: 0.00125 mmHg at 25°C.

Preparation of this chemical: The 1-Pyridin-2-ylthiourea could be obtained by the reactant of 1-benzoyl-3-pyridin-2-yl-thiourea, the reagent of NaOH, and the solvent of H₂O. The other condition is heating.



Uses of this chemical: The 2-Pyridylcyanamide could be obtained by the reactant of 1-Pyridin-2-ylthiourea, the reagent of HgO, and the solvent of acetone. In addition, this reaction should be taken for 45 minutes, and the yield is 42.9 %. The other condition is heating.

 

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin, so you should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. 

You can still convert the following datas into molecular structure: 
(1)SMILES: S=C(Nc1ncccc1)N
(2)InChI: InChI=1/C6H7N3S/c7-6(10)9-5-3-1-2-4-8-5/h1-4H,(H3,7,8,9,10)
(3)InChIKey: SLUHLANJIVXTRQ-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C6H7N3S/c7-6(10)9-5-3-1-2-4-8-5/h1-4H,(H3,7,8,9,10)
(5)Std. InChIKey: SLUHLANJIVXTRQ-UHFFFAOYSA-N