Found 4 results

Search term: YLNSNVGRSIOCEU (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (~2~H_3_)-2-Oxiranyl(~2~H_2_)methyl butyrate | C7H7D5O3

(2H3)-2-Oxiranyl(2H2)methyl butyrate

  • Molecular FormulaC7H7D5O3
  • Average mass149.199 Da
  • Monoisotopic mass149.110031 Da
  • ChemSpider ID107437358

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)-2-Oxiranyl(2H2)methyl butyrate [ACD/IUPAC Name]
(2H3)-2-Oxiranyl(2H2)methylbutyrat [German] [ACD/IUPAC Name]
Butanoic acid, oxiranyl-d3-methyl-d2 ester [ACD/Index Name]
Butyrate de (2H3)-2-oxiranyl(2H2)méthyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 196.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.3 mmHg at 25°C
Enthalpy of Vaporization: 43.2±3.0 kJ/mol
Flash Point: 85.0±0.0 °C
Index of Refraction: 1.444
Molar Refractivity: 35.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.29
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 2.70
ACD/KOC (pH 5.5): 70.95
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 2.70
ACD/KOC (pH 7.4): 70.95
Polar Surface Area: 39 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 134.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement