ChemSpider 2D Image | (2Z)-2-Hexen-4-ynal | C6H6O

(2Z)-2-Hexen-4-ynal

  • Molecular FormulaC6H6O
  • Average mass94.111 Da
  • Monoisotopic mass94.041862 Da
  • ChemSpider ID21865918
  • Double-bond stereo - Double-bond stereo


More details:






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

(2Z)-2-Hexen-4-inal [German] [ACD/IUPAC Name]
(2Z)-2-Hexen-4-ynal [ACD/IUPAC Name]
(2Z)-2-Hexén-4-ynal [French] [ACD/IUPAC Name]
(Z)-hex-2-en-4-ynal
2-Hexen-4-ynal, (2Z)- [ACD/Index Name]
(2Z)-hex-2-en-4-ynal
34501-87-6 [RN]
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:51782

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

Density: 0.9±0.1 g/cm3
Boiling Point: 154.8±23.0 °C at 760 mmHg
Vapour Pressure: 3.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.2±3.0 kJ/mol
Flash Point: 46.3±17.6 °C
Index of Refraction: 1.464
Molar Refractivity: 28.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.22
ACD/KOC (pH 5.5): 113.55
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.22
ACD/KOC (pH 7.4): 113.55
Polar Surface Area: 17 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 33.6±3.0 dyne/cm
Molar Volume: 101.8±3.0 cm3

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