Found 66 results

Search term: MF = 'C_{8}H_{6}ClF_{3}N_{2}O_{4}'
ChemSpider 2D Image | 2-[(5-Chloro-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl]-3,3,3-trifluoropropanoic acid | C8H6ClF3N2O4

2-[(5-Chloro-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl]-3,3,3-trifluoropropanoic acid

  • Molecular FormulaC8H6ClF3N2O4
  • Average mass286.592 Da
  • Monoisotopic mass285.996826 Da
  • ChemSpider ID36736637

More details:

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

1(2H)-Pyrimidinepropanoic acid, 5-chloro-3,4-dihydro-2,4-dioxo-α-(trifluoromethyl)- [ACD/Index Name]
2-[(5-Chlor-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl]-3,3,3-trifluorpropansäure [German] [ACD/IUPAC Name]
2-[(5-Chloro-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methyl]-3,3,3-trifluoropropanoic acid [ACD/IUPAC Name]
Acide 2-[(5-chloro-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)méthyl]-3,3,3-trifluoropropanoïque [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.528
Molar Refractivity: 51.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): -2.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 54.2±5.0 dyne/cm
Molar Volume: 166.7±5.0 cm3

Click to predict properties on the Chemicalize site


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