ChemSpider 2D Image | 4-(4-Heptanyloxy)-2,6-dimethoxybenzoic acid | C16H24O5

4-(4-Heptanyloxy)-2,6-dimethoxybenzoic acid

  • Molecular FormulaC16H24O5
  • Average mass296.359 Da
  • Monoisotopic mass296.162384 Da
  • ChemSpider ID28588069

More details:

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

4-(4-Heptanyloxy)-2,6-dimethoxybenzoesäure [German] [ACD/IUPAC Name]
4-(4-Heptanyloxy)-2,6-dimethoxybenzoic acid [ACD/IUPAC Name]
Acide 4-(4-heptanyloxy)-2,6-diméthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2,6-dimethoxy-4-(1-propylbutoxy)- [ACD/Index Name]
2,6-dimethoxy-4-(1-propylbutoxy)Benzoic acid
4-(Heptan-4-yloxy)-2,6-dimethoxybenzoic acid
4-[(Heptan-4-yl)oxy]-2,6-dimethoxybenzoic acid
917981-33-0 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 420.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 146.6±20.8 °C
Index of Refraction: 1.504
Molar Refractivity: 81.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 13.82
ACD/KOC (pH 5.5): 98.23
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.63
Polar Surface Area: 65 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 273.4±3.0 cm3

Click to predict properties on the Chemicalize site


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