ChemSpider 2D Image | 2-Bromo-5-[(1S,2R)-1,2-difluorocyclobutyl]thiophene | C8H7BrF2S

2-Bromo-5-[(1S,2R)-1,2-difluorocyclobutyl]thiophene

  • Molecular FormulaC8H7BrF2S
  • Average mass253.107 Da
  • Monoisotopic mass251.941986 Da
  • ChemSpider ID122905616

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-Brom-5-[(1S,2R)-1,2-difluorcyclobutyl]thiophen [German] [ACD/IUPAC Name]
2-Bromo-5-[(1S,2R)-1,2-difluorocyclobutyl]thiophene [ACD/IUPAC Name]
2-Bromo-5-[(1S,2R)-1,2-difluorocyclobutyl]thiophène [French] [ACD/IUPAC Name]
Thiophene, 2-bromo-5-[(1S,2R)-1,2-difluorocyclobutyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 259.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.7±3.0 kJ/mol
Flash Point: 110.8±27.3 °C
Index of Refraction: 1.564
Molar Refractivity: 49.3±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 87.72
ACD/KOC (pH 5.5): 856.04
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 87.72
ACD/KOC (pH 7.4): 856.04
Polar Surface Area: 28 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 40.8±5.0 dyne/cm
Molar Volume: 151.5±5.0 cm3

Click to predict properties on the Chemicalize site


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