ChemSpider 2D Image | friedelane | C30H52

friedelane

  • Molecular FormulaC30H52
  • Average mass412.734 Da
  • Monoisotopic mass412.406891 Da
  • ChemSpider ID20056444
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(4aR,6aR,6bS,8aR,9S,12aR,12bS,14aS,14bR)-2,2,4a,6a,8a,9,12b,14a-Octamethyldocosahydropicen [German] [ACD/IUPAC Name]
(4aR,6aR,6bS,8aR,9S,12aR,12bS,14aS,14bR)-2,2,4a,6a,8a,9,12b,14a-Octamethyldocosahydropicene [ACD/IUPAC Name]
(4aR,6aR,6bS,8aR,9S,12aR,12bS,14aS,14bR)-2,2,4a,6a,8a,9,12b,14a-Octaméthyldocosahydropicène [French] [ACD/IUPAC Name]
(4β,5β,8α,9β,10α,13α,14β)-5,9,13-Trimethyl-24,25,26-trinoroleanane
559-73-9 [RN]
friedelane
Picene, docosahydro-2,2,4a,6a,8a,9,12b,14a-octamethyl-, (4aR,6aR,6bS,8aR,9S,12aR,12bS,14aS,14bR)- [ACD/Index Name]
(4AR,6AR,6BS,8AR,9S,12AR,12BS,14AS,14BR)-2,2,4A,6A,8A,9,12B,14A-OCTAMETHYL-DOCOSAHYDROPICENE
(4AR,6AR,6BS,8AR,9S,12AR,12BS,14AS,14BR)-2,2,4A,6A,8A,9,12B,14A-OCTAMETHYL-HEXADECAHYDROPICENE
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:71575

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 453.8±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 68.6±0.8 kJ/mol
Flash Point: 220.4±13.1 °C
Index of Refraction: 1.497
Molar Refractivity: 130.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 13.49
ACD/LogD (pH 5.5): 12.19
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.19
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 446.5±3.0 cm3

Click to predict properties on the Chemicalize site






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