ChemSpider 2D Image | 4-Bromo-2,5-heptadiyne | C7H7Br

4-Bromo-2,5-heptadiyne

  • Molecular FormulaC7H7Br
  • Average mass171.035 Da
  • Monoisotopic mass169.973099 Da
  • ChemSpider ID60743962

More details:

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

2,5-Heptadiyne, 4-bromo- [ACD/Index Name]
4-Brom-2,5-heptadiin [German] [ACD/IUPAC Name]
4-Bromo-2,5-heptadiyne [ACD/IUPAC Name]
4-Bromo-2,5-heptadiyne [French] [ACD/IUPAC Name]
50428-60-9 [RN]
MFCD20625803

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

Density: 1.4±0.1 g/cm3
Boiling Point: 200.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.9±3.0 kJ/mol
Flash Point: 78.8±20.4 °C
Index of Refraction: 1.527
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 69.05
ACD/KOC (pH 5.5): 721.23
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 69.05
ACD/KOC (pH 7.4): 721.23
Polar Surface Area: 0 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 124.3±3.0 cm3

Click to predict properties on the Chemicalize site


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