ChemSpider 2D Image | 5,10,15,20,25,30,35,40-Octakis(bromomethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.2~3,6~.2~8,11~.2~13,16~.2~18,21~.2~23,26~.2~28,31~.2~33,36~]hexapentacontane-41,42,4 3,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol | C48H72Br8O32

5,10,15,20,25,30,35,40-Octakis(bromomethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane-41,42,4 3,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol

  • Molecular FormulaC48H72Br8O32
  • Average mass1800.298 Da
  • Monoisotopic mass1791.747314 Da
  • ChemSpider ID21429455

More details:

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

5,10,15,20,25,30,35,40-Octakis(brommethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontan-41,42,43, 44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol [German] [ACD/IUPAC Name]
5,10,15,20,25,30,35,40-Octakis(bromomethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane-41,42,4 3,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol [ACD/IUPAC Name]
5,10,15,20,25,30,35,40-Octakis(bromométhyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadécaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane-41,42,4 3,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadécol [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.608
Molar Refractivity: 319.4±0.3 cm3
#H bond acceptors: 32
#H bond donors: 16
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 1.89
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.24
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.24
Polar Surface Area: 471 Å2
Polarizability: 126.6±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 924.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement