ChemSpider 2D Image | (2E)-3-Chloro-2-propen-1-yl (2S)-2-hydroxypropanoate | C6H9ClO3

(2E)-3-Chloro-2-propen-1-yl (2S)-2-hydroxypropanoate

  • Molecular FormulaC6H9ClO3
  • Average mass164.587 Da
  • Monoisotopic mass164.024017 Da
  • ChemSpider ID61329231

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-3-Chlor-2-propen-1-yl-(2S)-2-hydroxypropanoat [German] [ACD/IUPAC Name]
(2E)-3-Chloro-2-propen-1-yl (2S)-2-hydroxypropanoate [ACD/IUPAC Name]
(2S)-2-Hydroxypropanoate de (2E)-3-chloro-2-propén-1-yle [French] [ACD/IUPAC Name]
Propanoic acid, 2-hydroxy-, (2E)-3-chloro-2-propen-1-yl ester, (2S)- [ACD/Index Name]
2089518-17-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 251.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 56.8±6.0 kJ/mol
Flash Point: 106.0±23.2 °C
Index of Refraction: 1.480
Molar Refractivity: 38.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 4.39
ACD/KOC (pH 5.5): 100.31
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 4.39
ACD/KOC (pH 7.4): 100.31
Polar Surface Area: 47 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 133.9±3.0 cm3

Click to predict properties on the Chemicalize site


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