ChemSpider 2D Image | N-Benzyl-1-(6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin-2-yl)methanamine | C32H41NO8

N-Benzyl-1-(6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin-2-yl)methanamine

  • Molecular FormulaC32H41NO8
  • Average mass567.670 Da
  • Monoisotopic mass567.283203 Da
  • ChemSpider ID9290359

More details:

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

Dibenz[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin-2-methanamine, 6,7,9,10,12,13,20,21,23,24,26,27-dodecahydro-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-1-(6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin-2-yl)methanamin [German] [ACD/IUPAC Name]
N-Benzyl-1-(6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosin-2-yl)methanamine [ACD/IUPAC Name]
N-Benzyl-1-(6,7,9,10,12,13,20,21,23,24,26,27-dodécahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotétracosin-2-yl)méthanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 701.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 304.4±22.3 °C
Index of Refraction: 1.513
Molar Refractivity: 155.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.35
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 4.34
ACD/KOC (pH 7.4): 38.63
Polar Surface Area: 86 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 516.0±3.0 cm3

Click to predict properties on the Chemicalize site


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