ChemSpider 2D Image | Methyl [(3-methyl-2-butenoyl)amino][2-(trifluoromethyl)phenyl]acetate | C15H16F3NO3

Methyl [(3-methyl-2-butenoyl)amino][2-(trifluoromethyl)phenyl]acetate

  • Molecular FormulaC15H16F3NO3
  • Average mass315.288 Da
  • Monoisotopic mass315.108215 Da
  • ChemSpider ID30325467

More details:

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

[(3-Méthyl-2-butenoyl)amino][2-(trifluorométhyl)phényl]acétate de méthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-[(3-methyl-1-oxo-2-buten-1-yl)amino]-2-(trifluoromethyl)-, methyl ester [ACD/Index Name]
Methyl [(3-methyl-2-butenoyl)amino][2-(trifluoromethyl)phenyl]acetate [ACD/IUPAC Name]
Methyl-[(3-methyl-2-butenoyl)amino][2-(trifluormethyl)phenyl]acetat [German] [ACD/IUPAC Name]
METHYL 2-(3-METHYLBUT-2-ENAMIDO)-2-[2-(TRIFLUOROMETHYL)PHENYL]ACETATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 431.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 214.8±28.7 °C
Index of Refraction: 1.484
Molar Refractivity: 73.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.13
ACD/KOC (pH 5.5): 780.71
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.13
ACD/KOC (pH 7.4): 780.71
Polar Surface Area: 55 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 258.4±3.0 cm3

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