ChemSpider 2D Image | Ethyl (5S,8S,14S)-14-hydroxy-5,8,11-triisobutyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oate | C30H48N4O8

Ethyl (5S,8S,14S)-14-hydroxy-5,8,11-triisobutyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oate

  • Molecular FormulaC30H48N4O8
  • Average mass592.724 Da
  • Monoisotopic mass592.347229 Da
  • ChemSpider ID25056571

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5S,8S,14S)-14-Hydroxy-5,8,11-triisobutyl-3,6,9,12-tétraoxo-1-phényl-2-oxa-4,7,10,11-tétraazapentadécan-15-oate d'éthyle [French] [ACD/IUPAC Name]
Ethyl (5S,8S,14S)-14-hydroxy-5,8,11-triisobutyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oate [ACD/IUPAC Name]
Ethyl (5s,8s,14s)-14-Hydroxy-5,8,11-Tris(2-Methylpropyl)-3,6,9,12-Tetraoxo-1-Phenyl-2-Oxa-4,7,10,11-Tetraazapentadecan-15-Oate
Ethyl-(5S,8S,14S)-14-hydroxy-5,8,11-triisobutyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,11-tetraazapentadecan-15-oat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.520
Molar Refractivity: 157.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 123.32
ACD/KOC (pH 5.5): 1092.35
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 123.18
ACD/KOC (pH 7.4): 1091.16
Polar Surface Area: 163 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 517.2±3.0 cm3

Click to predict properties on the Chemicalize site


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