Found 107 results

Search term: MF = 'C_{28}H_{47}N_{3}O_{5}S'
ChemSpider 2D Image | 2-Methyl-2-propanyl [1-{[2-(butylamino)-1-(3-hydroxyphenyl)-2-oxoethyl](hexyl)amino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate | C28H47N3O5S

2-Methyl-2-propanyl [1-{[2-(butylamino)-1-(3-hydroxyphenyl)-2-oxoethyl](hexyl)amino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate

  • Molecular FormulaC28H47N3O5S
  • Average mass537.755 Da
  • Monoisotopic mass537.323669 Da
  • ChemSpider ID16521580

More details:

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

[1-{[2-(Butylamino)-1-(3-hydroxyphényl)-2-oxoéthyl](hexyl)amino}-4-(méthylsulfanyl)-1-oxo-2-butanyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [1-{[2-(butylamino)-1-(3-hydroxyphenyl)-2-oxoethyl](hexyl)amino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[1-{[2-(butylamino)-1-(3-hydroxyphenyl)-2-oxoethyl](hexyl)amino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[[[2-(butylamino)-1-(3-hydroxyphenyl)-2-oxoethyl]hexylamino]carbonyl]-3-(methylthio)propyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 699.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.6±3.0 kJ/mol
Flash Point: 377.0±34.3 °C
Index of Refraction: 1.536
Molar Refractivity: 151.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 2305.72
ACD/KOC (pH 5.5): 4916.99
ACD/LogD (pH 7.4): 4.93
ACD/BCF (pH 7.4): 1895.07
ACD/KOC (pH 7.4): 4041.27
Polar Surface Area: 140 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 39.5±7.0 dyne/cm
Molar Volume: 484.7±7.0 cm3

Click to predict properties on the Chemicalize site


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