ChemSpider 2D Image | 1-(4-Bromo-5-chloro-2-thienyl)-1-butanamine | C8H11BrClNS

1-(4-Bromo-5-chloro-2-thienyl)-1-butanamine

  • Molecular FormulaC8H11BrClNS
  • Average mass268.602 Da
  • Monoisotopic mass266.948395 Da
  • ChemSpider ID51989506

More details:

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

1-(4-Brom-5-chlor-2-thienyl)-1-butanamin [German] [ACD/IUPAC Name]
1-(4-Bromo-5-chloro-2-thienyl)-1-butanamine [ACD/IUPAC Name]
1-(4-Bromo-5-chloro-2-thiényl)-1-butanamine [French] [ACD/IUPAC Name]
2-Thiophenemethanamine, 4-bromo-5-chloro-α-propyl- [ACD/Index Name]
1603053-62-8 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 312.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.3±3.0 kJ/mol
Flash Point: 142.7±26.5 °C
Index of Refraction: 1.587
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.48
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 13.07
ACD/KOC (pH 7.4): 116.66
Polar Surface Area: 54 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 177.3±3.0 cm3

Click to predict properties on the Chemicalize site


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