Found 225 results

Search term: MF = 'C_{18}H_{15}F_{4}NO_{4}'
ChemSpider 2D Image | N-(3,4-Difluorobenzyl)-N-[(2,4-difluorophenoxy)acetyl]-beta-alanine | C18H15F4NO4

N-(3,4-Difluorobenzyl)-N-[(2,4-difluorophenoxy)acetyl]-β-alanine

  • Molecular FormulaC18H15F4NO4
  • Average mass385.310 Da
  • Monoisotopic mass385.093719 Da
  • ChemSpider ID53678336

More details:

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

N-(3,4-Difluorbenzyl)-N-[(2,4-difluorphenoxy)acetyl]-β-alanin [German] [ACD/IUPAC Name]
N-(3,4-Difluorobenzyl)-N-[(2,4-difluorophenoxy)acetyl]-β-alanine [ACD/IUPAC Name]
N-(3,4-Difluorobenzyl)-N-[2-(2,4-difluorophénoxy)acétyl]-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-[2-(2,4-difluorophenoxy)acetyl]-N-[(3,4-difluorophenyl)methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 557.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.3±3.0 kJ/mol
Flash Point: 290.9±30.1 °C
Index of Refraction: 1.543
Molar Refractivity: 85.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 1.91
ACD/KOC (pH 5.5): 21.67
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 272.5±3.0 cm3

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