ChemSpider 2D Image | acetiromate | C15H9I3O5

acetiromate

  • Molecular FormulaC15H9I3O5
  • Average mass649.942 Da
  • Monoisotopic mass649.758362 Da
  • ChemSpider ID15877

More details:






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

2260-08-4 [RN]
3434
4-(4-Acetoxy-3-iodophenoxy)-3,5-diiodobenzoic acid [ACD/IUPAC Name]
4-(4-Acetoxy-3-iodphenoxy)-3,5-diiodbenzoesäure [German] [ACD/IUPAC Name]
8Q5153W1NW
acetiromate [INN]
acétiromate [French] [INN]
acetiromato [Spanish] [INN]
acetiromatum [Latin] [INN]
Acide 4-(4-acétoxy-3-iodophénoxy)-3,5-diiodobenzoïque [French] [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

TBF 43 [DBID]

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

Density: 2.4±0.1 g/cm3
Boiling Point: 561.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 293.2±30.1 °C
Index of Refraction: 1.724
Molar Refractivity: 109.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 108.13
ACD/KOC (pH 5.5): 285.15
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 7.50
ACD/KOC (pH 7.4): 19.78
Polar Surface Area: 73 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 66.4±3.0 dyne/cm
Molar Volume: 276.4±3.0 cm3

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