ChemSpider 2D Image | N-[(6-Methylergolin-8-yl)methyl]acetamide | C18H23N3O

N-[(6-Methylergolin-8-yl)methyl]acetamide

  • Molecular FormulaC18H23N3O
  • Average mass297.395 Da
  • Monoisotopic mass297.184113 Da
  • ChemSpider ID28529612

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

Acetamide, N-[(6-methylergolin-8-yl)methyl]- [ACD/Index Name]
N-[(6-Methylergolin-8-yl)methyl]acetamid [German] [ACD/IUPAC Name]
N-[(6-Methylergolin-8-yl)methyl]acetamide [ACD/IUPAC Name]
N-[(6-Méthylergolin-8-yl)méthyl]acétamide [French] [ACD/IUPAC Name]
3031-48-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 558.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 291.3±27.3 °C
Index of Refraction: 1.613
Molar Refractivity: 88.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 3.63
ACD/KOC (pH 7.4): 48.81
Polar Surface Area: 48 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 254.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement