ChemSpider 2D Image | 4-Butoxy-3-iodobenzoic acid | C11H13IO3

4-Butoxy-3-iodobenzoic acid

  • Molecular FormulaC11H13IO3
  • Average mass320.124 Da
  • Monoisotopic mass319.990936 Da
  • ChemSpider ID23960098

More details:

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

4-Butoxy-3-iodbenzoesäure [German] [ACD/IUPAC Name]
4-Butoxy-3-iodobenzoic acid [ACD/IUPAC Name]
Acide 4-butoxy-3-iodobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-butoxy-3-iodo- [ACD/Index Name]
1131614-07-7 [RN]
4-butoxy-3-iodanyl-benzoic acid
4-BUTOXY-3-IODOBENZOIC ACID|4-BUTOXY-3-IODOBENZOIC ACID
4-butoxy-3-iodobenzoicacid
MFCD11110783 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 391.1±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 190.3±25.1 °C
Index of Refraction: 1.590
Molar Refractivity: 66.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 20.77
ACD/KOC (pH 5.5): 123.80
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.69
Polar Surface Area: 47 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 197.6±3.0 cm3

Click to predict properties on the Chemicalize site


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