ChemSpider 2D Image | 4-[(3-Bromobenzyl)oxy]-3-chlorobenzoic acid | C14H10BrClO3

4-[(3-Bromobenzyl)oxy]-3-chlorobenzoic acid

  • Molecular FormulaC14H10BrClO3
  • Average mass341.584 Da
  • Monoisotopic mass339.950165 Da
  • ChemSpider ID32860181

More details:

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

4-[(3-Brombenzyl)oxy]-3-chlorbenzoesäure [German] [ACD/IUPAC Name]
4-[(3-Bromobenzyl)oxy]-3-chlorobenzoic acid [ACD/IUPAC Name]
Acide 4-[(3-bromobenzyl)oxy]-3-chlorobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(3-bromophenyl)methoxy]-3-chloro- [ACD/Index Name]
1275449-85-8 [RN]
4-(3-Bromo-benzyloxy)-3-chloro-benzoic acid
4-[(3-bromophenyl)methoxy]-3-chlorobenzoic acid
MFCD19106416

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

Density: 1.6±0.1 g/cm3
Boiling Point: 468.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 237.2±25.9 °C
Index of Refraction: 1.635
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 180.61
ACD/KOC (pH 5.5): 551.32
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 6.01
ACD/KOC (pH 7.4): 18.35
Polar Surface Area: 47 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 214.8±3.0 cm3

Click to predict properties on the Chemicalize site


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