ChemSpider 2D Image | 5-Chloro-N-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4,6-pyrimidinediamine | C10H13ClN6

5-Chloro-N-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4,6-pyrimidinediamine

  • Molecular FormulaC10H13ClN6
  • Average mass252.703 Da
  • Monoisotopic mass252.089020 Da
  • ChemSpider ID35197394

More details:

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

4,6-Pyrimidinediamine, 5-chloro-N4-methyl-N4-[2-(1H-pyrazol-1-yl)ethyl]- [ACD/Index Name]
5-Chlor-N-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
5-Chloro-N-methyl-N-[2-(1H-pyrazol-1-yl)ethyl]-4,6-pyrimidinediamine [ACD/IUPAC Name]
5-Chloro-N-méthyl-N-[2-(1H-pyrazol-1-yl)éthyl]-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 435.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.1±28.7 °C
Index of Refraction: 1.678
Molar Refractivity: 66.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 12.26
ACD/KOC (pH 5.5): 205.04
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.17
ACD/KOC (pH 7.4): 220.24
Polar Surface Area: 73 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 177.6±7.0 cm3

Click to predict properties on the Chemicalize site


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