ChemSpider 2D Image | (2E,4E)-6-Chloro-2,4-hexadienenitrile | C6H6ClN

(2E,4E)-6-Chloro-2,4-hexadienenitrile

  • Molecular FormulaC6H6ClN
  • Average mass127.572 Da
  • Monoisotopic mass127.018875 Da
  • ChemSpider ID27016475

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E)-6-Chlor-2,4-hexadiennitril [German] [ACD/IUPAC Name]
(2E,4E)-6-Chloro-2,4-hexadienenitrile [ACD/IUPAC Name]
(2E,4E)-6-Chloro-2,4-hexadiènenitrile [French] [ACD/IUPAC Name]
2,4-Hexadienenitrile, 6-chloro-, (2E,4E)- [ACD/Index Name]
877462-81-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 247.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.5±3.0 kJ/mol
Flash Point: 111.3±17.6 °C
Index of Refraction: 1.493
Molar Refractivity: 34.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.17
ACD/KOC (pH 5.5): 96.74
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.17
ACD/KOC (pH 7.4): 96.74
Polar Surface Area: 24 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 119.6±3.0 cm3

Click to predict properties on the Chemicalize site


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