ChemSpider 2D Image | Methyl 4-amino-3-bromo-5-iodobenzoate | C8H7BrINO2

Methyl 4-amino-3-bromo-5-iodobenzoate

  • Molecular FormulaC8H7BrINO2
  • Average mass355.955 Da
  • Monoisotopic mass354.870453 Da
  • ChemSpider ID58180773

More details:

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

4-Amino-3-bromo-5-iodobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-amino-3-bromo-5-iodo-, methyl ester [ACD/Index Name]
Methyl 4-amino-3-bromo-5-iodobenzoate [ACD/IUPAC Name]
Methyl-4-amino-3-brom-5-iodbenzoat [German] [ACD/IUPAC Name]
1240113-86-3 [RN]
MFCD23378830

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

Density: 2.1±0.1 g/cm3
Boiling Point: 398.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.9±3.0 kJ/mol
Flash Point: 194.7±27.9 °C
Index of Refraction: 1.672
Molar Refractivity: 62.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.49
ACD/KOC (pH 5.5): 1247.71
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.49
ACD/KOC (pH 7.4): 1247.71
Polar Surface Area: 52 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 167.9±3.0 cm3

Click to predict properties on the Chemicalize site


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