Found 1 result

Search term: KXGZHYZDRUARHJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1,7,13-Triisopropyl-4,10,16-trimethyl-6H,12H,18H-tribenzo[b,f,j][1,5,9]trioxacyclododecine-6,12,18-trione | C33H36O6

1,7,13-Triisopropyl-4,10,16-trimethyl-6H,12H,18H-tribenzo[b,f,j][1,5,9]trioxacyclododecine-6,12,18-trione

  • Molecular FormulaC33H36O6
  • Average mass528.635 Da
  • Monoisotopic mass528.251160 Da
  • ChemSpider ID173642

More details:

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

1,7,13-Triisopropyl-4,10,16-trimethyl-6H,12H,18H-tribenzo[b,f,j][1,5,9]trioxacyclododecin-6,12,18-trion [German] [ACD/IUPAC Name]
1,7,13-Triisopropyl-4,10,16-trimethyl-6H,12H,18H-tribenzo[b,f,j][1,5,9]trioxacyclododecine-6,12,18-trione [ACD/IUPAC Name]
1,7,13-Triisopropyl-4,10,16-triméthyl-6H,12H,18H-tribenzo[b,f,j][1,5,9]trioxacyclododécine-6,12,18-trione [French] [ACD/IUPAC Name]
6H,12H,18H-Tribenzo[b,f,j][1,5,9]trioxacyclododecin-6,12,18-trione, 4,10,16-trimethyl-1,7,13-tris(1-methylethyl)- [ACD/Index Name]
2281-45-0 [RN]
4-19-00-05134 [Beilstein]
6H,12H,18H-Tribenzo(b,f,j)(1,5,9)trioxacyclododecin-6,12,18-trione, 4,10,16-trimethyl-1,7,13-tris(1-methylethyl)-
6H,12H,18H-TRIBENZO[B,F,J][1,5,9]TRIOXACYCLODODECIN-6,12,18-TRIONE,4,10,16-TRIMETHYL-1,7,13-TRIS(1-METHYLETHYL)-
p-Cymene-3-carboxylic acid, 2-hydroxy-, trimol. cyclic ester (7CI)
Tricarvocrotide

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

BRN 0069768 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 658.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.0±3.0 kJ/mol
Flash Point: 275.2±31.5 °C
Index of Refraction: 1.559
Molar Refractivity: 149.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 10.49
ACD/LogD (pH 5.5): 8.22
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 707427.38
ACD/LogD (pH 7.4): 8.22
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 707427.38
Polar Surface Area: 79 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 464.0±3.0 cm3

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