ChemSpider 2D Image | [8-(2,6-Dimethyl-4-morpholinyl)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]acetic acid | C14H19N5O5

[8-(2,6-Dimethyl-4-morpholinyl)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]acetic acid

  • Molecular FormulaC14H19N5O5
  • Average mass337.331 Da
  • Monoisotopic mass337.138611 Da
  • ChemSpider ID21929726

More details:

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

[8-(2,6-Dimethyl-4-morpholinyl)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]acetic acid [ACD/IUPAC Name]
[8-(2,6-Dimethyl-4-morpholinyl)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]essigsäure [German] [ACD/IUPAC Name]
7H-Purine-7-acetic acid, 8-(2,6-dimethyl-4-morpholinyl)-1,2,3,6-tetrahydro-3-methyl-2,6-dioxo- [ACD/Index Name]
Acide [8-(2,6-diméthyl-4-morpholinyl)-3-méthyl-2,6-dioxo-1,2,3,6-tétrahydro-7H-purin-7-yl]acétique [French] [ACD/IUPAC Name]
1021099-29-5 [RN]
2-(8-(2,6-dimethylmorpholino)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)acetic acid
2-(8-(2,6-dimethylmorpholino)-3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetic acid
2-[8-(2,6-dimethylmorpholin-4-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]acetic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.717
Molar Refractivity: 81.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -2.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 66.4±7.0 dyne/cm
Molar Volume: 207.3±7.0 cm3

Click to predict properties on the Chemicalize site


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