ChemSpider 2D Image | N-(3-Amino-4-methylpentyl)-2-[(3,4-difluorophenyl)sulfanyl]-N-methylacetamide | C15H22F2N2OS

N-(3-Amino-4-methylpentyl)-2-[(3,4-difluorophenyl)sulfanyl]-N-methylacetamide

  • Molecular FormulaC15H22F2N2OS
  • Average mass316.410 Da
  • Monoisotopic mass316.142090 Da
  • ChemSpider ID63946544

More details:

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

Acetamide, N-(3-amino-4-methylpentyl)-2-[(3,4-difluorophenyl)thio]-N-methyl- [ACD/Index Name]
N-(3-Amino-4-methylpentyl)-2-[(3,4-difluorophenyl)sulfanyl]-N-methylacetamide [ACD/IUPAC Name]
N-(3-Amino-4-méthylpentyl)-2-[(3,4-difluorophényl)sulfanyl]-N-méthylacétamide [French] [ACD/IUPAC Name]
N-(3-Amino-4-methylpentyl)-2-[(3,4-difluorphenyl)sulfanyl]-N-methylacetamid [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: 411.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 202.6±28.7 °C
Index of Refraction: 1.538
Molar Refractivity: 84.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.48
Polar Surface Area: 72 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 42.6±5.0 dyne/cm
Molar Volume: 269.4±5.0 cm3

Click to predict properties on the Chemicalize site


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