Found 157 results

Search term: MF = 'C_{32}H_{41}NO_{4}'
ChemSpider 2D Image | (6beta,7alpha)-17-(Cyclobutylmethyl)-7-(hydroxymethyl)-3-methoxy-7-(3-phenylpropyl)-4,5-epoxymorphinan-6-ol | C32H41NO4

(6β,7α)-17-(Cyclobutylmethyl)-7-(hydroxymethyl)-3-methoxy-7-(3-phenylpropyl)-4,5-epoxymorphinan-6-ol

  • Molecular FormulaC32H41NO4
  • Average mass503.672 Da
  • Monoisotopic mass503.303558 Da
  • ChemSpider ID23109791

  • defined stereocentres - 2 of 6 defined stereocentres

More details:

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

(6β,7α)-17-(Cyclobutylmethyl)-7-(hydroxymethyl)-3-methoxy-7-(3-phenylpropyl)-4,5-epoxymorphinan-6-ol [ACD/IUPAC Name]
(6β,7α)-17-(Cyclobutylmethyl)-7-(hydroxymethyl)-3-methoxy-7-(3-phenylpropyl)-4,5-epoxymorphinan-6-ol [German] [ACD/IUPAC Name]
(6β,7α)-17-(Cyclobutylméthyl)-7-(hydroxyméthyl)-3-méthoxy-7-(3-phénylpropyl)-4,5-époxymorphinane-6-ol [French] [ACD/IUPAC Name]
Morphinan-6-ol, 17-(cyclobutylmethyl)-4,5-epoxy-7-(hydroxymethyl)-3-methoxy-7-(3-phenylpropyl)-, (6β,7α)- [ACD/Index Name]
4-cyclobutylmethyl-14-hydroxy-10-methoxy-15-(3-phenylpropyl)-(14R,15R)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-15-ylmethanol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 662.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 354.4±31.5 °C
Index of Refraction: 1.647
Molar Refractivity: 144.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 6.49
ACD/KOC (pH 5.5): 24.10
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 311.14
ACD/KOC (pH 7.4): 1154.78
Polar Surface Area: 62 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 396.5±5.0 cm3

Click to predict properties on the Chemicalize site


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