ChemSpider 2D Image | 2-(2-Propyn-1-yl)-4-pentynoate | C8H7O2

2-(2-Propyn-1-yl)-4-pentynoate

  • Molecular FormulaC8H7O2
  • Average mass135.141 Da
  • Monoisotopic mass135.045151 Da
  • ChemSpider ID77420060
  • Charge - Charge


More details:






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

2-(2-Propin-1-yl)-4-pentinoat [German] [ACD/IUPAC Name]
2-(2-Propyn-1-yl)-4-pentynoate [ACD/IUPAC Name]
2-(2-Propyn-1-yl)-4-pentynoate [French] [ACD/IUPAC Name]
4-Pentynoic acid, 2-(2-propyn-1-yl)-, ion(1-) [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 264.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.3±6.0 kJ/mol
Flash Point: 121.4±19.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.95
ACD/LogD (pH 5.5): -0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.56
ACD/LogD (pH 7.4): -2.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






Advertisement