Welcome to LookChem.com Sign In|Join Free

Product Name

  • or
Home > Products > 

3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde

Basic Information Post buying leads Suppliers
  • Name 3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde
  • EINECSN/A
  • CAS No. 175277-27-7
  • Density1.3g/cm3
  • PSA79.05000
  • LogP1.48768
  • SolubilityN/A
  • Melting Point140 °C
  • FormulaC8H6N2OS
  • Boiling Point339.9 °C at 760 mmHg
  • Molecular Weight178.214
  • Flash Point159.4 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety26-36/37-39
  • Risk Codes Xn:Harmful;
  • Molecular Structure
    Molecular Structure of 175277-27-7 (6-FORMYL-2-(METHYLSULFANYL)NICOTINONITRILE)
  • Hazard SymbolsR20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
  • SynonymsR20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system

3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde Specification

The 3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde, with CAS registry number 175277-27-7, has the systematic name of 6-formyl-2-(methylsulfanyl)pyridine-3-carbonitrile. Besides this, it is also called 6-Formyl-2-(methylsulfanyl)nicotinonitrile. And the chemical formula of this chemical is C8H6N2OS.

Physical properties of 3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde: (1)ACD/LogP: 1.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.7; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 11.55; (6)ACD/BCF (pH 7.4): 11.55; (7)ACD/KOC (pH 5.5): 200.61; (8)ACD/KOC (pH 7.4): 200.61; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 79.05 Å2; (13)Index of Refraction: 1.6; (14)Molar Refractivity: 46.72 cm3; (15)Molar Volume: 136.5 cm3; (16)Polarizability: 18.52×10-24cm3; (17)Surface Tension: 64.1 dyne/cm; (18)Density: 1.3 g/cm3; (19)Flash Point: 159.4 °C; (20)Enthalpy of Vaporization: 58.34 kJ/mol; (21)Boiling Point: 339.9 °C at 760 mmHg; (22)Vapour Pressure: 8.9E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1nc(SC)c(C#N)cc1
(2)InChI: InChI=1/C8H6N2OS/c1-12-8-6(4-9)2-3-7(5-11)10-8/h2-3,5H,1H3
(3)InChIKey: UBGVOMZGBKLUOU-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C8H6N2OS/c1-12-8-6(4-9)2-3-7(5-11)10-8/h2-3,5H,1H3
(5)Std. InChIKey: UBGVOMZGBKLUOU-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 175277-27-7
Related Products

Hot Products

Post a RFQ