ChemSpider 2D Image | (4-Fluoro-2-methoxyphenyl)[{[5-(methoxymethyl)-1H-pyrazol-3-yl]methyl}(methyl)amino]acetic acid | C16H20FN3O4

(4-Fluoro-2-methoxyphenyl)[{[5-(methoxymethyl)-1H-pyrazol-3-yl]methyl}(methyl)amino]acetic acid

  • Molecular FormulaC16H20FN3O4
  • Average mass337.346 Da
  • Monoisotopic mass337.143799 Da
  • ChemSpider ID29521115

More details:

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

(4-Fluor-2-methoxyphenyl)[{[5-(methoxymethyl)-1H-pyrazol-3-yl]methyl}(methyl)amino]essigsäure [German] [ACD/IUPAC Name]
(4-Fluoro-2-methoxyphenyl)[{[5-(methoxymethyl)-1H-pyrazol-3-yl]methyl}(methyl)amino]acetic acid [ACD/IUPAC Name]
Acide (4-fluoro-2-méthoxyphényl)[{[5-(méthoxyméthyl)-1H-pyrazol-3-yl]méthyl}(méthyl)amino]acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 4-fluoro-2-methoxy-α-[[[5-(methoxymethyl)-1H-pyrazol-3-yl]methyl]methylamino]- [ACD/Index Name]
(4-FLUORO-2-METHOXYPHENYL)({[5-(METHOXYMETHYL)-1H-PYRAZOL-3-YL]METHYL}(METHYL)AMINO)ACETIC ACID
2-(4-FLUORO-2-METHOXYPHENYL)-2-({[5-(METHOXYMETHYL)-1H-PYRAZOL-3-YL]METHYL}(METHYL)AMINO)ACETIC ACID

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

Density: 1.3±0.1 g/cm3
Boiling Point: 484.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 246.9±28.7 °C
Index of Refraction: 1.577
Molar Refractivity: 85.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): -0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.73
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 257.5±3.0 cm3

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