Product Name

  • Name

    2,4-BIS(TRICHLOROMETHYL)-6-METHYL-1,3,5-TRIAZINE

  • EINECS 213-440-5
  • CAS No. 949-42-8
  • Article Data14
  • CAS DataBase
  • Density 1.754 g/cm3
  • Solubility
  • Melting Point 94.0 to 98.0 °C
  • Formula C6H3Cl6N3
  • Boiling Point 342.956 °C at 760 mmHg
  • Molecular Weight 329.828
  • Flash Point 191.883 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 949-42-8 (2,4-BIS(TRICHLOROMETHYL)-6-METHYL-1,3,5-TRIAZINE)
  • Hazard Symbols
  • Synonyms s-Triazine,2-methyl-4,6-bis(trichloromethyl)- (7CI,8CI);2,4-Bis(trichloromethyl)-6-methyl-s-triazine;2-Methyl-4,6-bis(trichloromethyl)-s-triazine;NSC 409354;
  • PSA 38.67000
  • LogP 3.83340

2-Methyl-4,6-bis(trichloromethyl)-1,3,5-triazine Specification

The 2-Methyl-4,6-bis(trichloromethyl)-1,3,5-triazine, with the CAS registry number 949-42-8, is also known as 2-Methyl-4,6-bis(trichloromethyl)-s-triazine. Its EINECS number is 213-440-5. This chemical's molecular formula is C6H3Cl6N3 and molecular weight is 329.83. What's more, its systematic name is 2-Methyl-4,6-bis(trichloromethyl)-1,3,5-triazine.

Physical properties of 2-Methyl-4,6-bis(trichloromethyl)-1,3,5-triazine are: (1)ACD/LogP: 3.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.78; (4)ACD/LogD (pH 7.4): 3.78; (5)ACD/BCF (pH 5.5): 439.34; (6)ACD/BCF (pH 7.4): 439.34; (7)ACD/KOC (pH 5.5): 2712.18; (8)ACD/KOC (pH 7.4): 2712.18; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 38.67 Å2; (13)Index of Refraction: 1.59; (14)Molar Refractivity: 63.424 cm3; (15)Molar Volume: 188.022 cm3; (16)Polarizability: 25.143×10-24cm3; (17)Surface Tension: 56.5 dyne/cm; (18)Density: 1.754 g/cm3; (19)Flash Point: 191.883 °C; (20)Enthalpy of Vaporization: 56.355 kJ/mol; (21)Boiling Point: 342.956 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(Cl)(Cl)c1nc(nc(n1)C(Cl)(Cl)Cl)C
(2)Std. InChI: InChI=1S/C6H3Cl6N3/c1-2-13-3(5(7,8)9)15-4(14-2)6(10,11)12/h1H3
(3)Std. InChIKey: LETDRANQSOEVCX-UHFFFAOYSA-N

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