Found 2 results

Search term: MF = 'C_{26}H_{33}Br_{4}N_{3}O_{3}'
ChemSpider 2D Image | psammaplysene I | C26H33Br4N3O3

psammaplysene I

  • Molecular FormulaC26H33Br4N3O3
  • Average mass755.174 Da
  • Monoisotopic mass750.925537 Da
  • ChemSpider ID65328921

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(3-{2,6-Dibrom-4-[2-(methylamino)ethyl]phenoxy}propyl)-3-{3,5-dibrom-4-[3-(methylamino)propoxy]phenyl}-N-methylacrylamid [German] [ACD/IUPAC Name]
(2E)-N-(3-{2,6-Dibromo-4-[2-(methylamino)ethyl]phenoxy}propyl)-3-{3,5-dibromo-4-[3-(methylamino)propoxy]phenyl}-N-methylacrylamide [ACD/IUPAC Name]
(2E)-N-(3-{2,6-Dibromo-4-[2-(méthylamino)éthyl]phénoxy}propyl)-3-{3,5-dibromo-4-[3-(méthylamino)propoxy]phényl}-N-méthylacrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-[3-[2,6-dibromo-4-[2-(methylamino)ethyl]phenoxy]propyl]-3-[3,5-dibromo-4-[3-(methylamino)propoxy]phenyl]-N-methyl-, (2E)- [ACD/Index Name]
psammaplysene I

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

Density: 1.6±0.1 g/cm3
Boiling Point: 764.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 416.1±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 163.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 5.03
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 1.18
ACD/KOC (pH 5.5): 2.68
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 2.84
Polar Surface Area: 63 Å2
Polarizability: 64.8±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 474.4±3.0 cm3

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