ChemSpider 2D Image | 5-[2-(Aminomethyl)-4-methyl-1,3-thiazol-5-yl]-4H-1,2,4-triazole-3,4-diamine | C7H11N7S

5-[2-(Aminomethyl)-4-methyl-1,3-thiazol-5-yl]-4H-1,2,4-triazole-3,4-diamine

  • Molecular FormulaC7H11N7S
  • Average mass225.274 Da
  • Monoisotopic mass225.079666 Da
  • ChemSpider ID35914349

More details:

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

4H-1,2,4-Triazole-3,4-diamine, 5-[2-(aminomethyl)-4-methyl-5-thiazolyl]- [ACD/Index Name]
5-[2-(Aminomethyl)-4-methyl-1,3-thiazol-5-yl]-4H-1,2,4-triazol-3,4-diamin [German] [ACD/IUPAC Name]
5-[2-(Aminomethyl)-4-methyl-1,3-thiazol-5-yl]-4H-1,2,4-triazole-3,4-diamine [ACD/IUPAC Name]
5-[2-(Aminométhyl)-4-méthyl-1,3-thiazol-5-yl]-4H-1,2,4-triazole-3,4-diamine [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 538.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 279.2±32.9 °C
Index of Refraction: 1.940
Molar Refractivity: 56.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -2.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.73
Polar Surface Area: 150 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 101.4±7.0 dyne/cm
Molar Volume: 117.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement