ChemSpider 2D Image | Pelosine | C36H38N2O6

Pelosine

  • Molecular FormulaC36H38N2O6
  • Average mass594.697 Da
  • Monoisotopic mass594.273010 Da
  • ChemSpider ID10198034
  • defined stereocentres - 2 of 2 defined stereocentres


More details:



Featured data source



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

(1'α)-6,6'-Dimethoxy-2,2'-dimethyltubocuraran-7',12'-diol
(1β,1'α)-6,6'-Dimethoxy-2,2'-dimethyltubocuraran-7',12'-diol [German] [ACD/IUPAC Name]
(1β,1'α)-6,6'-Dimethoxy-2,2'-dimethyltubocuraran-7',12'-diol [ACD/IUPAC Name]
(1β,1'α)-6,6'-Diméthoxy-2,2'-diméthyltubocuraran-7',12'-diol [French] [ACD/IUPAC Name]
1'a-6,6'-Dimethoxy-2,2'-dimethyltubocuraran-7',12'-diol
207-516-7 [EINECS]
477-58-7 [RN]
477-60-1 [RN]
BEBEERINE
Chondodendrine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

01MDR0WU2J [DBID]
C09352 [DBID]
UNII:01MDR0WU2J [DBID]
UNII-01MDR0WU2J [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 706.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.0±3.0 kJ/mol
Flash Point: 381.1±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 168.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 0.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 160.71
ACD/KOC (pH 7.4): 805.45
Polar Surface Area: 84 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 480.0±3.0 cm3

Click to predict properties on the Chemicalize site






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