Found 145 results

Search term: MF = 'C_{9}H_{8}F_{3}N_{3}O_{5}'
ChemSpider 2D Image | N-[6-Oxo-4-(trifluoromethyl)-1,6-dihydro-2-pyrimidinyl]aspartic acid | C9H8F3N3O5

N-[6-Oxo-4-(trifluoromethyl)-1,6-dihydro-2-pyrimidinyl]aspartic acid

  • Molecular FormulaC9H8F3N3O5
  • Average mass295.172 Da
  • Monoisotopic mass295.041595 Da
  • ChemSpider ID28892335

More details:

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

Acide N-[6-oxo-4-(trifluorométhyl)-1,6-dihydro-2-pyrimidinyl]aspartique [French] [ACD/IUPAC Name]
Aspartic acid, N-[1,6-dihydro-6-oxo-4-(trifluoromethyl)-2-pyrimidinyl]- [ACD/Index Name]
N-[6-Oxo-4-(trifluormethyl)-1,6-dihydro-2-pyrimidinyl]asparaginsäure [German] [ACD/IUPAC Name]
N-[6-Oxo-4-(trifluoromethyl)-1,6-dihydro-2-pyrimidinyl]aspartic acid [ACD/IUPAC Name]

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: 1.587
Molar Refractivity: 55.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.67
ACD/LogD (pH 5.5): -2.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 163.7±7.0 cm3

Click to predict properties on the Chemicalize site


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