ChemSpider 2D Image | 7-Chloro-2-oxoheptanoic acid | C7H11ClO3

7-Chloro-2-oxoheptanoic acid

  • Molecular FormulaC7H11ClO3
  • Average mass178.613 Da
  • Monoisotopic mass178.039673 Da
  • ChemSpider ID21396794

More details:

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

7-Chlor-2-oxoheptansäure [German] [ACD/IUPAC Name]
7-Chloro-2-oxoheptanoic acid [ACD/IUPAC Name]
874886-74-5 [RN]
Acide 7-chloro-2-oxoheptanoïque [French] [ACD/IUPAC Name]
Heptanoic acid, 7-chloro-2-oxo- [ACD/Index Name]
HEPTANOIC ACID,7-CHLORO-2-OXO-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 277.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 56.8±6.0 kJ/mol
Flash Point: 121.8±22.6 °C
Index of Refraction: 1.468
Molar Refractivity: 40.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): -1.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 147.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement