Found 870 results

Search term: MF = 'C_{12}H_{12}ClN_{5}S'
ChemSpider 2D Image | N-(2-Chloro-3-methylphenyl)-3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine | C12H12ClN5S

N-(2-Chloro-3-methylphenyl)-3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine

  • Molecular FormulaC12H12ClN5S
  • Average mass293.775 Da
  • Monoisotopic mass293.050201 Da
  • ChemSpider ID21666334

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7H-1,2,4-Triazolo[3,4-b][1,3,4]thiadiazin-6-amine, N-(2-chloro-3-methylphenyl)-3-methyl- [ACD/Index Name]
N-(2-Chlor-3-methylphenyl)-3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amin [German] [ACD/IUPAC Name]
N-(2-Chloro-3-methylphenyl)-3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine [ACD/IUPAC Name]
N-(2-Chloro-3-méthylphényl)-3-méthyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine [French] [ACD/IUPAC Name]
(2-Chloro-3-methyl-phenyl)-(3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)-amine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 478.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 243.0±31.5 °C
Index of Refraction: 1.752
Molar Refractivity: 78.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.78
ACD/KOC (pH 5.5): 485.96
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.80
ACD/KOC (pH 7.4): 486.23
Polar Surface Area: 80 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 192.0±7.0 cm3

Click to predict properties on the Chemicalize site


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