Found 397 results

Search term: MF = 'C_{18}H_{34}N_{2}O_{4}'
ChemSpider 2D Image | 1-[(3R,4R)-3-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-4-(hydroxymethyl)-1-pyrrolidinyl]-3-methoxy-2,2-dimethyl-1-propanone | C18H34N2O4

1-[(3R,4R)-3-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-4-(hydroxymethyl)-1-pyrrolidinyl]-3-methoxy-2,2-dimethyl-1-propanone

  • Molecular FormulaC18H34N2O4
  • Average mass342.474 Da
  • Monoisotopic mass342.251862 Da
  • ChemSpider ID29681276

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-[(3R,4R)-3-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-4-(hydroxymethyl)-1-pyrrolidinyl]-3-methoxy-2,2-dimethyl-1-propanon [German] [ACD/IUPAC Name]
1-[(3R,4R)-3-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-4-(hydroxymethyl)-1-pyrrolidinyl]-3-methoxy-2,2-dimethyl-1-propanone [ACD/IUPAC Name]
1-[(3R,4R)-3-{[(2R,6S)-2,6-Diméthyl-4-morpholinyl]méthyl}-4-(hydroxyméthyl)-1-pyrrolidinyl]-3-méthoxy-2,2-diméthyl-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[(3R,4R)-3-[[(2R,6S)-2,6-dimethyl-4-morpholinyl]methyl]-4-(hydroxymethyl)-1-pyrrolidinyl]-3-methoxy-2,2-dimethyl- [ACD/Index Name]
[(3R*,4R*)-4-{[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]methyl}-1-(3-methoxy-2,2-dimethylpropanoyl)-3-pyrrolidinyl]methanol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 474.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.0±6.0 kJ/mol
Flash Point: 240.7±24.6 °C
Index of Refraction: 1.488
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.02
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 30.77
Polar Surface Area: 62 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 324.2±3.0 cm3

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