ChemSpider 2D Image | Ethyl 4,5-bis(chloromethyl)-1,2-oxazole-3-carboxylate | C8H9Cl2NO3

Ethyl 4,5-bis(chloromethyl)-1,2-oxazole-3-carboxylate

  • Molecular FormulaC8H9Cl2NO3
  • Average mass238.068 Da
  • Monoisotopic mass236.995956 Da
  • ChemSpider ID65420868

More details:

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

104169-04-2 [RN]
3-Isoxazolecarboxylic acid, 4,5-bis(chloromethyl)-, ethyl ester [ACD/Index Name]
4,5-Bis(chlorométhyl)-1,2-oxazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4,5-bis(chloromethyl)-1,2-oxazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-4,5-bis(chlormethyl)-1,2-oxazol-3-carboxylat [German] [ACD/IUPAC Name]
MFCD31690211

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

Density: 1.4±0.1 g/cm3
Boiling Point: 390.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.7±27.9 °C
Index of Refraction: 1.512
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 17.73
ACD/KOC (pH 5.5): 272.53
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 17.73
ACD/KOC (pH 7.4): 272.53
Polar Surface Area: 52 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 175.2±3.0 cm3

Click to predict properties on the Chemicalize site


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