ChemSpider 2D Image | 4-[4-(2-Amino-3,3-dihydroxy-2-propen-1-yl)-2-iodophenoxy]-2-iodophenyl hydrogen sulfate | C15H13I2NO7S

4-[4-(2-Amino-3,3-dihydroxy-2-propen-1-yl)-2-iodophenoxy]-2-iodophenyl hydrogen sulfate

  • Molecular FormulaC15H13I2NO7S
  • Average mass605.140 Da
  • Monoisotopic mass604.850220 Da
  • ChemSpider ID95629678

More details:

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

1-Propene-1,1-diol, 2-amino-3-[3-iodo-4-[3-iodo-4-(sulfooxy)phenoxy]phenyl]- [ACD/Index Name]
4-[4-(2-Amino-3,3-dihydroxy-2-propen-1-yl)-2-iodophenoxy]-2-iodophenyl hydrogen sulfate [ACD/IUPAC Name]
4-[4-(2-Amino-3,3-dihydroxy-2-propen-1-yl)-2-iodphenoxy]-2-iodphenylhydrogensulfat [German] [ACD/IUPAC Name]
Hydrogénosulfate de 4-[4-(2-amino-3,3-dihydroxy-2-propén-1-yl)-2-iodophénoxy]-2-iodophényle [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.755
Molar Refractivity: 111.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 5.09
ACD/LogD (pH 5.5): -1.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 85.3±3.0 dyne/cm
Molar Volume: 271.4±3.0 cm3

Click to predict properties on the Chemicalize site


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