ChemSpider 2D Image | 3-(7-Chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-N,N-dimethyl-1-propanamine | C9H13ClN6

3-(7-Chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-N,N-dimethyl-1-propanamine

  • Molecular FormulaC9H13ClN6
  • Average mass240.693 Da
  • Monoisotopic mass240.089020 Da
  • ChemSpider ID65399390

More details:

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

3-(7-Chlor-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-N,N-dimethyl-1-propanamin [German] [ACD/IUPAC Name]
3-(7-Chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-N,N-dimethyl-1-propanamine [ACD/IUPAC Name]
3-(7-Chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-N,N-diméthyl-1-propanamine [French] [ACD/IUPAC Name]
3H-1,2,3-Triazolo[4,5-d]pyrimidine-3-propanamine, 7-chloro-N,N-dimethyl- [ACD/Index Name]
(3-{7-chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl}propyl)dimethylamine
2171946-09-9 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 386.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 187.3±25.1 °C
Index of Refraction: 1.675
Molar Refractivity: 63.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.22
ACD/LogD (pH 5.5): -3.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 60 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 168.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement