ChemSpider 2D Image | 3-(Bromomethyl)-1,4-pentadiyne | C6H5Br

3-(Bromomethyl)-1,4-pentadiyne

  • Molecular FormulaC6H5Br
  • Average mass157.008 Da
  • Monoisotopic mass155.957458 Da
  • ChemSpider ID60743999

More details:

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

1,4-Pentadiyne, 3-(bromomethyl)- [ACD/Index Name]
3-(Brommethyl)-1,4-pentadiin [German] [ACD/IUPAC Name]
3-(Bromomethyl)-1,4-pentadiyne [ACD/IUPAC Name]
3-(Bromométhyl)-1,4-pentadiyne [French] [ACD/IUPAC Name]
89324-51-6 [RN]
MFCD20626059

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

Density: 1.4±0.1 g/cm3
Boiling Point: 176.4±35.0 °C at 760 mmHg
Vapour Pressure: 1.5±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.6±3.0 kJ/mol
Flash Point: 65.5±20.4 °C
Index of Refraction: 1.523
Molar Refractivity: 33.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.36
ACD/KOC (pH 5.5): 290.24
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.36
ACD/KOC (pH 7.4): 290.24
Polar Surface Area: 0 Å2
Polarizability: 13.2±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 108.7±3.0 cm3

Click to predict properties on the Chemicalize site


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