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2-(Propylthio)pyridine

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Name

2-(Propylthio)pyridine

EINECS N/A
CAS No. 26891-63-4 Density 1.04 g/cm3
PSA 38.19000 LogP 2.58370
Solubility N/A Melting Point N/A
Formula C8H11NS Boiling Point 245.5 °C at 760 mmHg
Molecular Weight 153.248 Flash Point 102.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 26891-63-4 (2-(Propylthio)pyridine) Hazard Symbols N/A
Synonyms

2-(PROPYLTHIO)PYRIDINE;2-Propylmercapto-pyridin;2-propylsulfanyl-pyridine;

 

2-(Propylthio)pyridine Specification

The CAS registry number of 2-(Propylthio)pyridine is 26891-63-4. It is also known as 2-Propylsulfanyl-pyridine. This chemical's molecular formula is C8H11NS and molecular weight is 153.2446. Its systematic name is called 2-(propylsulfanyl)pyridine.

Physical properties of this chemical are: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Index of Refraction: 1.548; (7)Molar Refractivity: 46.45 cm3; (8)Molar Volume: 146.2 cm3; (9)Surface Tension: 41.7 dyne/cm; (10)Density: 1.04 g/cm3; (11)Flash Point: 102.3 °C; (12)Enthalpy of Vaporization: 46.31 kJ/mol; (13)Boiling Point: 245.5 °C at 760 mmHg; (14)Vapour Pressure: 0.0448 mmHg at 25°C.  

Preparation: this chemical can be prepared by 1-propoxy-1H-pyridine-2-thione and 2-propylsulfanyl-pyridine. This reaction will need reagent ethyl 1-trimethylsilyloxyacrylate and solvent CH2Cl2. The temperature of this reaction is 0-5 °C. The yield is about 91%, while it also needs Irradiation.

2-propylsulfanyl-pyridine can be prepared by1-propoxy-1H-pyridine-2-thione and 2-propylsulfanyl-pyridine

You can still convert the following datas into molecular structure:
(1)SMILES: S(c1ncccc1)CCC
(2)InChI: InChI=1/C8H11NS/c1-2-7-10-8-5-3-4-6-9-8/h3-6H,2,7H2,1H3
(3)InChIKey: QGZPZAHIJZTNOD-UHFFFAOYAQ

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