ChemSpider 2D Image | Phenyl 2-hydroxy-5-iodobenzoate | C13H9IO3

Phenyl 2-hydroxy-5-iodobenzoate

  • Molecular FormulaC13H9IO3
  • Average mass340.113 Da
  • Monoisotopic mass339.959625 Da
  • ChemSpider ID23954037

More details:

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

1131622-42-8 [RN]
2-Hydroxy-5-iodobenzoate de phényle [French] [ACD/IUPAC Name]
Benzoic acid, 2-hydroxy-5-iodo-, phenyl ester [ACD/Index Name]
Phenyl 2-hydroxy-5-iodobenzoate [ACD/IUPAC Name]
Phenyl-2-hydroxy-5-iodbenzoat [German] [ACD/IUPAC Name]
2-(4-methoxyl)propane-2-ol
2-(4-methoxyphenyl)propan-2-ol
2-hydroxy-5-iodobenzoic acid phenyl ester
MFCD11112846 [MDL number]
phenyl 5-iodanyl-2-oxidanyl-benzoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point: 405.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 199.3±25.9 °C
Index of Refraction: 1.675
Molar Refractivity: 72.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1760.16
ACD/KOC (pH 5.5): 7318.99
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1468.57
ACD/KOC (pH 7.4): 6106.53
Polar Surface Area: 47 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 193.4±3.0 cm3

Click to predict properties on the Chemicalize site


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