Found 145 results

Search term: MF = 'C_{9}H_{8}F_{3}N_{3}O_{5}'
ChemSpider 2D Image | 3-(2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-N-(trifluoroacetyl)alanine | C9H8F3N3O5

3-(2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-N-(trifluoroacetyl)alanine

  • Molecular FormulaC9H8F3N3O5
  • Average mass295.172 Da
  • Monoisotopic mass295.041595 Da
  • ChemSpider ID114843420

More details:

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

3-(2,6-Dioxo-1,2,3,6-tétrahydro-4-pyrimidinyl)-N-(2,2,2-trifluoroacétyl)alanine [French] [ACD/IUPAC Name]
3-(2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-N-(trifluoracetyl)alanin [German] [ACD/IUPAC Name]
3-(2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-N-(trifluoroacetyl)alanine [ACD/IUPAC Name]
4-Pyrimidinepropanoic acid, 1,2,3,6-tetrahydro-2,6-dioxo-α-[(2,2,2-trifluoroacetyl)amino]- [ACD/Index Name]

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: 1.487
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): -2.65
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: 125 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 187.2±3.0 cm3

Click to predict properties on the Chemicalize site


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