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Search term: KDTPXFTVLRVORM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-(2,6-Dichlorophenyl)-2-methylene-4-pentynenitrile | C12H7Cl2N

5-(2,6-Dichlorophenyl)-2-methylene-4-pentynenitrile

  • Molecular FormulaC12H7Cl2N
  • Average mass236.097 Da
  • Monoisotopic mass234.995560 Da
  • ChemSpider ID84246143

More details:

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

4-Pentynenitrile, 5-(2,6-dichlorophenyl)-2-methylene- [ACD/Index Name]
5-(2,6-Dichlorophenyl)-2-methylene-4-pentynenitrile [ACD/IUPAC Name]
5-(2,6-Dichlorophényl)-2-méthylène-4-pentynenitrile [French] [ACD/IUPAC Name]
5-(2,6-Dichlorphenyl)-2-methylen-4-pentinnitril [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 382.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 165.9±22.1 °C
Index of Refraction: 1.589
Molar Refractivity: 61.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 4.67
ACD/BCF (pH 5.5): 2075.88
ACD/KOC (pH 5.5): 8242.32
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2075.88
ACD/KOC (pH 7.4): 8242.32
Polar Surface Area: 24 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 183.1±5.0 cm3

Click to predict properties on the Chemicalize site


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