ChemSpider 2D Image | (2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl 4-iodobenzoate | C12H9IN2O4

(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl 4-iodobenzoate

  • Molecular FormulaC12H9IN2O4
  • Average mass372.115 Da
  • Monoisotopic mass371.960693 Da
  • ChemSpider ID23151440

More details:

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

(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl 4-iodobenzoate [ACD/IUPAC Name]
(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl-4-iodbenzoat [German] [ACD/IUPAC Name]
4-Iodobenzoate de (2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-iodo-, (3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methyl ester [ACD/Index Name]
4-Iodo-benzoic acid 2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-ylmethyl ester

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.642
Molar Refractivity: 74.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 15.22
ACD/KOC (pH 5.5): 244.34
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 14.93
ACD/KOC (pH 7.4): 239.68
Polar Surface Area: 76 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 205.3±3.0 cm3

Click to predict properties on the Chemicalize site


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