ChemSpider 2D Image | 1-[(6-Bromo-4-quinolinyl)sulfanyl]cyclobutanecarboxylic acid | C14H12BrNO2S

1-[(6-Bromo-4-quinolinyl)sulfanyl]cyclobutanecarboxylic acid

  • Molecular FormulaC14H12BrNO2S
  • Average mass338.220 Da
  • Monoisotopic mass336.977203 Da
  • ChemSpider ID58872931

More details:

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

1-[(6-Brom-4-chinolinyl)sulfanyl]cyclobutancarbonsäure [German] [ACD/IUPAC Name]
1-[(6-Bromo-4-quinolinyl)sulfanyl]cyclobutanecarboxylic acid [ACD/IUPAC Name]
Acide 1-[(6-bromo-4-quinoléinyl)sulfanyl]cyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 1-[(6-bromo-4-quinolinyl)thio]- [ACD/Index Name]
1-((6-bromoquinolin-4-yl)thio)cyclobutane-1-carboxylic acid
1-(6-bromoquinolin-4-yl)sulfanylcyclobutane-1-carboxylic acid
1638327-48-6 [RN]
MFCD30803314
Ruzinurad

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

Density: 1.7±0.1 g/cm3
Boiling Point: 528.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.7±27.3 °C
Index of Refraction: 1.730
Molar Refractivity: 80.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.76
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 76.2±5.0 dyne/cm
Molar Volume: 202.0±5.0 cm3

Click to predict properties on the Chemicalize site


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