Found 4 results

Search term: MF = 'C_{8}H_{3}D_{4}BrO_{2}'
ChemSpider 2D Image | Methyl 3-bromo(~2~H_4_)benzoate | C8H3D4BrO2

Methyl 3-bromo(2H4)benzoate

  • Molecular FormulaC8H3D4BrO2
  • Average mass219.069 Da
  • Monoisotopic mass217.988037 Da
  • ChemSpider ID53606021

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Bromo(2H4)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic-2,3,4,6-d4 acid, 5-bromo-, methyl ester [ACD/Index Name]
Methyl 3-bromo(2H4)benzoate [ACD/IUPAC Name]
Methyl-3-brom(2H4)benzoat [German] [ACD/IUPAC Name]
1643575-37-4 [RN]
3-(Methoxycarbonyl)bromobenzene-2,4,5,6-d4

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

Density: 1.5±0.1 g/cm3
Boiling Point: 244.4±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 101.6±19.8 °C
Index of Refraction: 1.550
Molar Refractivity: 45.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 81.99
ACD/KOC (pH 5.5): 815.59
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 81.99
ACD/KOC (pH 7.4): 815.59
Polar Surface Area: 26 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 143.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement