ChemSpider 2D Image | 5,8,11,14,17,24,27,30,33,36,40,48-Dodecaoxa-50-azapentacyclo[19.17.11.1~42,46~.0~4,37~.0~18,23~]pentaconta-1,3,18,20,22,37,42(50),43,45-nonaene-41,47-dione | C37H45NO14

5,8,11,14,17,24,27,30,33,36,40,48-Dodecaoxa-50-azapentacyclo[19.17.11.142,46.04,37.018,23]pentaconta-1,3,18,20,22,37,42(50),43,45-nonaene-41,47-dione

  • Molecular FormulaC37H45NO14
  • Average mass727.752 Da
  • Monoisotopic mass727.283997 Da
  • ChemSpider ID30658798

More details:

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

5,8,11,14,17,24,27,30,33,36,40,48-Dodecaoxa-50-azapentacyclo[19.17.11.142,46.04,37.018,23]pentaconta-1,3,18,20,22,37,42(50),43,45-nonaen-41,47-dion [German] [ACD/IUPAC Name]
5,8,11,14,17,24,27,30,33,36,40,48-Dodecaoxa-50-azapentacyclo[19.17.11.142,46.04,37.018,23]pentaconta-1,3,18,20,22,37,42(50),43,45-nonaene-41,47-dione [ACD/IUPAC Name]
5,8,11,14,17,24,27,30,33,36,40,48-Dodécaoxa-50-azapentacyclo[19.17.11.142,46.04,37.018,23]pentaconta-1,3,18,20,22,37,42(50),43,45-nonaène-41,47-dione [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.501
Molar Refractivity: 182.0±0.3 cm3
#H bond acceptors: 15
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: -0.84
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 13.18
ACD/KOC (pH 5.5): 220.37
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.18
ACD/KOC (pH 7.4): 220.37
Polar Surface Area: 158 Å2
Polarizability: 72.1±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 618.1±3.0 cm3

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