ChemSpider 2D Image | 3,9,15,21-Tetraisobutyl-6,12,18,24-tetraisopropyl-4,10,16,22-tetramethyl-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosane-2,5,8,11,14,17,20,23-octone | C48H84N4O12

3,9,15,21-Tetraisobutyl-6,12,18,24-tetraisopropyl-4,10,16,22-tetramethyl-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosane-2,5,8,11,14,17,20,23-octone

  • Molecular FormulaC48H84N4O12
  • Average mass909.200 Da
  • Monoisotopic mass908.608582 Da
  • ChemSpider ID143137

More details:

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

1,7,13,19-Tetraoxa-4,10,16,22-tetraazacyclotetracosane-2,5,8,11,14,17,20,23-octone, 4,10,16,22-tetramethyl-6,12,18,24-tetrakis(1-methylethyl)-3,9,15,21-tetrakis(2-methylpropyl)- [ACD/Index Name]
3,9,15,21-Tetraisobutyl-6,12,18,24-tetraisopropyl-4,10,16,22-tetramethyl-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosan-2,5,8,11,14,17,20,23-octon [German] [ACD/IUPAC Name]
3,9,15,21-Tetraisobutyl-6,12,18,24-tetraisopropyl-4,10,16,22-tetramethyl-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosane-2,5,8,11,14,17,20,23-octone [ACD/IUPAC Name]
3,9,15,21-Tétraisobutyl-6,12,18,24-tétraisopropyl-4,10,16,22-tétraméthyl-1,7,13,19-tétraoxa-4,10,16,22-tétraazacyclotétracosane-2,5,8,11,14,17,20,23-octone [French] [ACD/IUPAC Name]
4,10,16,22-TETRAMETHYL-3,9,15,21-TETRAKIS(2-METHYLPROPYL)-6,12,18,24-TETRA(PROPAN-2-YL)-1,7,13,19-TETRAOXA-4,10,16,22-TETRAAZACYCLOTETRACOSANE-2,5,8,11,14,17,20,23-OCTONE
64763-82-2 [RN]
7325-42-0 [RN]

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

AIDS208087 [DBID]
AIDS-208087 [DBID]
NSC321804 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 1015.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 148.6±3.0 kJ/mol
Flash Point: 568.0±34.3 °C
Index of Refraction: 1.456
Molar Refractivity: 244.0±0.3 cm3
#H bond acceptors: 16
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 6.19
ACD/LogD (pH 5.5): 5.95
ACD/BCF (pH 5.5): 19569.67
ACD/KOC (pH 5.5): 41067.86
ACD/LogD (pH 7.4): 5.95
ACD/BCF (pH 7.4): 19569.67
ACD/KOC (pH 7.4): 41067.86
Polar Surface Area: 186 Å2
Polarizability: 96.7±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 898.4±3.0 cm3

Click to predict properties on the Chemicalize site


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