ChemSpider 2D Image | (3S)-N-[(4R)-2,2-Dimethyltetrahydro-2H-pyran-4-yl]-3-(4-isopropoxyphenyl)-N,4-dimethylpentanamide | C23H37NO3

(3S)-N-[(4R)-2,2-Dimethyltetrahydro-2H-pyran-4-yl]-3-(4-isopropoxyphenyl)-N,4-dimethylpentanamide

  • Molecular FormulaC23H37NO3
  • Average mass375.545 Da
  • Monoisotopic mass375.277344 Da
  • ChemSpider ID62502847

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S)-N-[(4R)-2,2-Dimethyltetrahydro-2H-pyran-4-yl]-3-(4-isopropoxyphenyl)-N,4-dimethylpentanamid [German] [ACD/IUPAC Name]
(3S)-N-[(4R)-2,2-Dimethyltetrahydro-2H-pyran-4-yl]-3-(4-isopropoxyphenyl)-N,4-dimethylpentanamide [ACD/IUPAC Name]
(3S)-N-[(4R)-2,2-Diméthyltétrahydro-2H-pyran-4-yl]-3-(4-isopropoxyphényl)-N,4-diméthylpentanamide [French] [ACD/IUPAC Name]
Benzenepropanamide, N-methyl-4-(1-methylethoxy)-β-(1-methylethyl)-N-[(4R)-tetrahydro-2,2-dimethyl-2H-pyran-4-yl]-, (βS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 493.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 252.1±28.7 °C
Index of Refraction: 1.516
Molar Refractivity: 110.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2620.13
ACD/KOC (pH 5.5): 9737.14
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2620.14
ACD/KOC (pH 7.4): 9737.15
Polar Surface Area: 39 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 38.4±5.0 dyne/cm
Molar Volume: 367.1±5.0 cm3

Click to predict properties on the Chemicalize site


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