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Search term: BVXPMFQVOWRQKD (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2S)-2,3-Dichloropropyl acetate | C5H8Cl2O2

(2S)-2,3-Dichloropropyl acetate

  • Molecular FormulaC5H8Cl2O2
  • Average mass171.022 Da
  • Monoisotopic mass169.990128 Da
  • ChemSpider ID61597628

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2,3-Dichloropropyl acetate [ACD/IUPAC Name]
(2S)-2,3-Dichlorpropyl-acetat [German] [ACD/IUPAC Name]
1-Propanol, 2,3-dichloro-, acetate, (2S)- [ACD/Index Name]
Acétate de (2S)-2,3-dichloropropyle [French] [ACD/IUPAC Name]
78692-86-1 [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: 199.3±20.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.5±3.0 kJ/mol
Flash Point: 80.9±20.8 °C
Index of Refraction: 1.445
Molar Refractivity: 36.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.28
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.97
ACD/KOC (pH 5.5): 205.69
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.97
ACD/KOC (pH 7.4): 205.69
Polar Surface Area: 26 Å2
Polarizability: 14.5±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 137.7±3.0 cm3

Click to predict properties on the Chemicalize site


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