ChemSpider 2D Image | (3Z)-4-Chloro-3-buten-2-one | C4H5ClO

(3Z)-4-Chloro-3-buten-2-one

  • Molecular FormulaC4H5ClO
  • Average mass104.535 Da
  • Monoisotopic mass104.002892 Da
  • ChemSpider ID61226373

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-4-Chlor-3-buten-2-on [German] [ACD/IUPAC Name]
(3Z)-4-Chloro-3-buten-2-one [ACD/IUPAC Name]
(3Z)-4-Chloro-3-butén-2-one [French] [ACD/IUPAC Name]
3-Buten-2-one, 4-chloro-, (3Z)- [ACD/Index Name]
4643-19-0 [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: 144.0±23.0 °C at 760 mmHg
Vapour Pressure: 5.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.1±3.0 kJ/mol
Flash Point: 41.8±13.7 °C
Index of Refraction: 1.441
Molar Refractivity: 25.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.07
ACD/KOC (pH 5.5): 77.67
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.07
ACD/KOC (pH 7.4): 77.67
Polar Surface Area: 17 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 27.8±3.0 dyne/cm
Molar Volume: 96.7±3.0 cm3

Click to predict properties on the Chemicalize site


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