Found 145 results

Search term: MF = 'C_{9}H_{8}F_{3}N_{3}O_{5}'
ChemSpider 2D Image | 3,3,3-Trifluoro-2-methyl-2-{[(4-nitro-1H-pyrrol-2-yl)carbonyl]amino}propanoic acid | C9H8F3N3O5

3,3,3-Trifluoro-2-methyl-2-{[(4-nitro-1H-pyrrol-2-yl)carbonyl]amino}propanoic acid

  • Molecular FormulaC9H8F3N3O5
  • Average mass295.172 Da
  • Monoisotopic mass295.041595 Da
  • ChemSpider ID36151417

More details:

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

3,3,3-Trifluor-2-methyl-2-{[(4-nitro-1H-pyrrol-2-yl)carbonyl]amino}propansäure [German] [ACD/IUPAC Name]
3,3,3-Trifluoro-2-methyl-2-{[(4-nitro-1H-pyrrol-2-yl)carbonyl]amino}propanoic acid [ACD/IUPAC Name]
Acide 3,3,3-trifluoro-2-méthyl-2-{[(4-nitro-1H-pyrrol-2-yl)carbonyl]amino}propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3,3,3-trifluoro-2-methyl-2-[[(4-nitro-1H-pyrrol-2-yl)carbonyl]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: 519.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 267.8±30.1 °C
Index of Refraction: 1.541
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): -2.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 180.5±3.0 cm3

Click to predict properties on the Chemicalize site


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