Found 1 result

Search term: BAZZRRXYDJAAKL (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2,5,8,11,14,20,23,26,29,32-Decaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaen-17-ylmethanol | C29H42O11

2,5,8,11,14,20,23,26,29,32-Decaoxatricyclo[31.3.1.115,19]octatriaconta-1(37),15(38),16,18,33,35-hexaen-17-ylmethanol

  • Molecular FormulaC29H42O11
  • Average mass566.637 Da
  • Monoisotopic mass566.272705 Da
  • ChemSpider ID8730375

More details:






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

2,5,8,11,14,20,23,26,29,32-Decaoxatricyclo[31.3.1.115,19]octatriaconta-1(37),15(38),16,18,33,35-hexaen-17-ylmethanol [ACD/IUPAC Name]
2,5,8,11,14,20,23,26,29,32-Decaoxatricyclo[31.3.1.115,19]octatriaconta-1(37),15(38),16,18,33,35-hexaen-17-ylmethanol [German] [ACD/IUPAC Name]
2,5,8,11,14,20,23,26,29,32-Décaoxatricyclo[31.3.1.115,19]octatriaconta-1(37),15(38),16,18,33,35-hexaén-17-ylméthanol [French] [ACD/IUPAC Name]
2,5,8,11,14,20,23,26,29,32-Decaoxatricyclo[31.3.1.115,19]octatriaconta-1(37),15,17,19(38),33,35-hexaene-17-methanol [ACD/Index Name]
{2,5,8,11,14,20,23,26,29,32-decaoxatricyclo[31.3.1.11?,1?]octatriaconta-1(37),15,17,19(38),33,35-hexaen-17-yl}methanol
191211-56-0 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 744.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.9±3.0 kJ/mol
Flash Point: 404.0±32.9 °C
Index of Refraction: 1.476
Molar Refractivity: 145.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 58.69
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 2.08
ACD/KOC (pH 7.4): 58.69
Polar Surface Area: 113 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 516.0±3.0 cm3

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