ChemSpider 2D Image | 6-Chloro-9-(4-chloro-2-butyn-1-yl)-9H-purin-2-amine | C9H7Cl2N5

6-Chloro-9-(4-chloro-2-butyn-1-yl)-9H-purin-2-amine

  • Molecular FormulaC9H7Cl2N5
  • Average mass256.091 Da
  • Monoisotopic mass255.007858 Da
  • ChemSpider ID28678967

More details:

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

6-Chlor-9-(4-chlor-2-butin-1-yl)-9H-purin-2-amin [German] [ACD/IUPAC Name]
6-Chloro-9-(4-chloro-2-butyn-1-yl)-9H-purin-2-amine [ACD/IUPAC Name]
6-Chloro-9-(4-chloro-2-butyn-1-yl)-9H-purin-2-amine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 6-chloro-9-(4-chloro-2-butyn-1-yl)- [ACD/Index Name]
121653-93-8 [RN]
6-Chloro-9-(4-chlorobut-2-yn-1-yl)-9H-purin-2-amine
9H-PURIN-2-AMINE, 6-CHLORO-9-(4-CHLORO-2-BUTYNYL)-

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

Density: 1.6±0.1 g/cm3
Boiling Point: 543.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.8±32.9 °C
Index of Refraction: 1.715
Molar Refractivity: 63.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.42
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 16.10
ACD/KOC (pH 5.5): 254.32
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 16.10
ACD/KOC (pH 7.4): 254.35
Polar Surface Area: 70 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 61.6±7.0 dyne/cm
Molar Volume: 160.8±7.0 cm3

Click to predict properties on the Chemicalize site


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