ChemSpider 2D Image | 2-Chloro-8-(3-chloro-1-propyn-1-yl)quinoline | C12H7Cl2N

2-Chloro-8-(3-chloro-1-propyn-1-yl)quinoline

  • Molecular FormulaC12H7Cl2N
  • Average mass236.097 Da
  • Monoisotopic mass234.995560 Da
  • ChemSpider ID86280077

More details:






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

2-Chlor-8-(3-chlor-1-propin-1-yl)chinolin [German] [ACD/IUPAC Name]
2-Chloro-8-(3-chloro-1-propyn-1-yl)quinoléine [French] [ACD/IUPAC Name]
2-Chloro-8-(3-chloro-1-propyn-1-yl)quinoline [ACD/IUPAC Name]
Quinoline, 2-chloro-8-(3-chloro-1-propyn-1-yl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 373.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 211.3±10.7 °C
Index of Refraction: 1.661
Molar Refractivity: 63.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 706.15
ACD/KOC (pH 5.5): 3809.29
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 706.15
ACD/KOC (pH 7.4): 3809.29
Polar Surface Area: 13 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 59.2±5.0 dyne/cm
Molar Volume: 172.2±5.0 cm3

Click to predict properties on the Chemicalize site






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