Found 126 results

Search term: MF = 'C_{20}H_{31}NO_{6}S'
ChemSpider 2D Image | 5-{[Isobutyryl(tetrahydro-2-furanylmethyl)amino]methyl}-2-methoxyphenyl 2-propanesulfonate | C20H31NO6S

5-{[Isobutyryl(tetrahydro-2-furanylmethyl)amino]methyl}-2-methoxyphenyl 2-propanesulfonate

  • Molecular FormulaC20H31NO6S
  • Average mass413.528 Da
  • Monoisotopic mass413.187195 Da
  • ChemSpider ID21544512

More details:

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

2-Propanesulfonate de 5-{[isobutyryl(tétrahydro-2-furanylméthyl)amino]méthyl}-2-méthoxyphényle [French] [ACD/IUPAC Name]
2-Propanesulfonic acid, 2-methoxy-5-[[(2-methyl-1-oxopropyl)[(tetrahydro-2-furanyl)methyl]amino]methyl]phenyl ester [ACD/Index Name]
5-{[Isobutyryl(tetrahydro-2-furanylmethyl)amino]methyl}-2-methoxyphenyl 2-propanesulfonate [ACD/IUPAC Name]
5-{[Isobutyryl(tetrahydro-2-furanylmethyl)amino]methyl}-2-methoxyphenyl-2-propansulfonat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 582.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±30.1 °C
Index of Refraction: 1.524
Molar Refractivity: 107.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.85
ACD/KOC (pH 5.5): 414.50
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.85
ACD/KOC (pH 7.4): 414.50
Polar Surface Area: 91 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 351.2±3.0 cm3

Click to predict properties on the Chemicalize site


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