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ChemSpider 2D Image | 1-(4-Methoxyphenyl)-4-[(methylamino)methyl]-2-pyrrolidinone | C13H18N2O2

1-(4-Methoxyphenyl)-4-[(methylamino)methyl]-2-pyrrolidinone

  • Molecular FormulaC13H18N2O2
  • Average mass234.294 Da
  • Monoisotopic mass234.136826 Da
  • ChemSpider ID23202570

More details:

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

1-(4-Methoxyphenyl)-4-[(methylamino)methyl]-2-pyrrolidinon [German] [ACD/IUPAC Name]
1-(4-Methoxyphenyl)-4-[(methylamino)methyl]-2-pyrrolidinone [ACD/IUPAC Name]
1-(4-Méthoxyphényl)-4-[(méthylamino)méthyl]-2-pyrrolidinone [French] [ACD/IUPAC Name]
1-(4-methoxyphenyl)-4-[(methylamino)methyl]pyrrolidin-2-one
2-Pyrrolidinone, 1-(4-methoxyphenyl)-4-[(methylamino)methyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL434221/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 447.0±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 224.2±21.8 °C
Index of Refraction: 1.540
Molar Refractivity: 66.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -2.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 42 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 210.9±3.0 cm3

Click to predict properties on the Chemicalize site


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