ChemSpider 2D Image | [2-Bromo-4-(ethylsulfanyl)phenyl]acetic acid | C10H11BrO2S

[2-Bromo-4-(ethylsulfanyl)phenyl]acetic acid

  • Molecular FormulaC10H11BrO2S
  • Average mass275.162 Da
  • Monoisotopic mass273.966309 Da
  • ChemSpider ID60835624

More details:

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

[2-Brom-4-(ethylsulfanyl)phenyl]essigsäure [German] [ACD/IUPAC Name]
[2-Bromo-4-(ethylsulfanyl)phenyl]acetic acid [ACD/IUPAC Name]
Acide [2-bromo-4-(éthylsulfanyl)phényl]acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-bromo-4-(ethylthio)- [ACD/Index Name]
1823084-85-0 [RN]
2-[2-bromo-4-(ethylsulfanyl)phenyl]acetic acid
MFCD22483738

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

Density: 1.6±0.1 g/cm3
Boiling Point: 391.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 190.3±26.5 °C
Index of Refraction: 1.625
Molar Refractivity: 62.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 10.54
ACD/KOC (pH 5.5): 73.10
ACD/LogD (pH 7.4): 0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.31
Polar Surface Area: 63 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 57.5±5.0 dyne/cm
Molar Volume: 177.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement