Found 226 results

Search term: MF = 'C_{17}H_{21}F_{3}N_{2}O_{5}'
ChemSpider 2D Image | (2Z)-4-({2-[Bis(2-methoxyethyl)amino]-5-(trifluoromethyl)phenyl}amino)-4-oxo-2-butenoic acid | C17H21F3N2O5

(2Z)-4-({2-[Bis(2-methoxyethyl)amino]-5-(trifluoromethyl)phenyl}amino)-4-oxo-2-butenoic acid

  • Molecular FormulaC17H21F3N2O5
  • Average mass390.354 Da
  • Monoisotopic mass390.140259 Da
  • ChemSpider ID29383578

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-4-({2-[Bis(2-methoxyethyl)amino]-5-(trifluormethyl)phenyl}amino)-4-oxo-2-butensäure [German] [ACD/IUPAC Name]
(2Z)-4-({2-[Bis(2-methoxyethyl)amino]-5-(trifluoromethyl)phenyl}amino)-4-oxo-2-butenoic acid [ACD/IUPAC Name]
2-Butenoic acid, 4-[[2-[bis(2-methoxyethyl)amino]-5-(trifluoromethyl)phenyl]amino]-4-oxo-, (2Z)- [ACD/Index Name]
Acide (2Z)-4-({2-[bis(2-méthoxyéthyl)amino]-5-(trifluorométhyl)phényl}amino)-4-oxo-2-buténoïque [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 534.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 277.1±30.1 °C
Index of Refraction: 1.543
Molar Refractivity: 92.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): -0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 294.0±3.0 cm3

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