ChemSpider 2D Image | N-(2-Ethoxy-3,5-dimethylbenzyl)-1H-tetrazol-5-amine | C12H17N5O

N-(2-Ethoxy-3,5-dimethylbenzyl)-1H-tetrazol-5-amine

  • Molecular FormulaC12H17N5O
  • Average mass247.296 Da
  • Monoisotopic mass247.143311 Da
  • ChemSpider ID35033701

More details:






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

1H-Tetrazol-5-amine, N-[(2-ethoxy-3,5-dimethylphenyl)methyl]- [ACD/Index Name]
N-(2-Ethoxy-3,5-dimethylbenzyl)-1H-tetrazol-5-amin [German] [ACD/IUPAC Name]
N-(2-Ethoxy-3,5-dimethylbenzyl)-1H-tetrazol-5-amine [ACD/IUPAC Name]
N-(2-Éthoxy-3,5-diméthylbenzyl)-1H-tétrazol-5-amine [French] [ACD/IUPAC Name]
1Q9

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 423.6±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 210.0±29.3 °C
Index of Refraction: 1.615
Molar Refractivity: 70.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 20.65
ACD/KOC (pH 5.5): 269.13
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.03
ACD/KOC (pH 7.4): 13.41
Polar Surface Area: 76 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 200.6±3.0 cm3

Click to predict properties on the Chemicalize site






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