ChemSpider 2D Image | (3S)-3-Bromo-1-chlorobutane | C4H8BrCl

(3S)-3-Bromo-1-chlorobutane

  • Molecular FormulaC4H8BrCl
  • Average mass171.463 Da
  • Monoisotopic mass169.949783 Da
  • ChemSpider ID61663225

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Brom-1-chlorbutan [German] [ACD/IUPAC Name]
(3S)-3-Bromo-1-chlorobutane [ACD/IUPAC Name]
(3S)-3-Bromo-1-chlorobutane [French] [ACD/IUPAC Name]
Butane, 3-bromo-1-chloro-, (3S)- [ACD/Index Name]
49623-67-8 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 151.3±13.0 °C at 760 mmHg
Vapour Pressure: 4.7±0.3 mmHg at 25°C
Enthalpy of Vaporization: 37.2±3.0 kJ/mol
Flash Point: 55.8±9.9 °C
Index of Refraction: 1.466
Molar Refractivity: 33.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.82
ACD/KOC (pH 5.5): 650.88
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.82
ACD/KOC (pH 7.4): 650.88
Polar Surface Area: 0 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 29.8±3.0 dyne/cm
Molar Volume: 119.5±3.0 cm3

Click to predict properties on the Chemicalize site


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