Product Name

  • Name

    2-BROMO-6-(METHYLTHIO)PYRIDINE

  • EINECS
  • CAS No. 74134-42-2
  • Article Data10
  • CAS DataBase
  • Density 1.617 g/cm3
  • Solubility
  • Melting Point
  • Formula C6H6BrNS
  • Boiling Point 269.731 °C at 760 mmHg
  • Molecular Weight 204.09
  • Flash Point 116.93 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 74134-42-2 (2-BROMO-6-(METHYLTHIO)PYRIDINE)
  • Hazard Symbols IrritantXi
  • Synonyms 2-Bromo-6-(methylsulfanyl)pyridine;2-Bromo-6-methylsulfenylpyridine;2-Bromo-6-methylthiopyridine;2-Methylthio-6-bromopyridine;
  • PSA 38.19000
  • LogP 2.56600

Pyridine,2-bromo-6-(methylthio)- Specification

The Pyridine, 2-bromo-6-(methylthio)-, with the CAS registry number 74134-42-2, is also known as 2-Bromo-6-methylthiopyridine. This chemical's molecular formula is C6H6BrNS and molecular weight is 204.09. What's more, its systematic name is 2-Bromo-6-(methylsulfanyl)pyridine. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Pyridine, 2-bromo-6-(methylthio)- are: (1)ACD/LogP: 2.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 47; (6)ACD/BCF (pH 7.4): 47; (7)ACD/KOC (pH 5.5): 548; (8)ACD/KOC (pH 7.4): 548; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.19 Å2; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 44.911 cm3; (15)Molar Volume: 126.245 cm3; (16)Polarizability: 17.804×10-24 cm3; (17)Surface Tension: 54.278 dyne/cm; (18)Density: 1.617 g/cm3; (19)Flash Point: 116.93 °C; (20)Enthalpy of Vaporization: 48.742 kJ/mol; (21)Boiling Point: 269.731 °C at 760 mmHg; (22)Vapour Pressure: 0.012 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CSc1cccc(Br)n1
(2) InChI: InChI=1/C6H6BrNS/c1-9-6-4-2-3-5(7)8-6/h2-4H,1H3
(3) InChIKey: CWFMGEWBDIDVPZ-UHFFFAOYAM

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