ChemSpider 2D Image | 2-Chloro-4-{4-[2,3-dimethyl-4-(3-methylbutanoyl)phenoxy]butoxy}benzoic acid | C24H29ClO5

2-Chloro-4-{4-[2,3-dimethyl-4-(3-methylbutanoyl)phenoxy]butoxy}benzoic acid

  • Molecular FormulaC24H29ClO5
  • Average mass432.937 Da
  • Monoisotopic mass432.170349 Da
  • ChemSpider ID34218820

More details:

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

2-Chlor-4-{4-[2,3-dimethyl-4-(3-methylbutanoyl)phenoxy]butoxy}benzoesäure [German] [ACD/IUPAC Name]
2-Chloro-4-{4-[2,3-dimethyl-4-(3-methylbutanoyl)phenoxy]butoxy}benzoic acid [ACD/IUPAC Name]
Acide 2-chloro-4-{4-[2,3-diméthyl-4-(3-méthylbutanoyl)phénoxy]butoxy}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-4-[4-[2,3-dimethyl-4-(3-methyl-1-oxobutyl)phenoxy]butoxy]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 608.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 322.0±31.5 °C
Index of Refraction: 1.554
Molar Refractivity: 118.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 6.84
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 320.63
ACD/KOC (pH 5.5): 531.59
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 35.40
ACD/KOC (pH 7.4): 58.70
Polar Surface Area: 73 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 369.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement