ChemSpider 2D Image | (5Z,8E,11E,17E,22Z,25E,28E,34E)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyl-2,3,10,13,16,18,19,20,24,27,30,33-dodecahydro-1H,7H-dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19,
22,25,28]decaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-decol | C60H92N12O10

(5Z,8E,11E,17E,22Z,25E,28E,34E)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyl-2,3,10,13,16,18,19,20,24,27,30,33-dodecahydro-1H,7H-dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19, 22,25,28]decaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-decol

  • Molecular FormulaC60H92N12O10
  • Average mass1141.447 Da
  • Monoisotopic mass1140.705933 Da
  • ChemSpider ID95635858
  • Double-bond stereo - Double-bond stereo


More details:






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

(5Z,8E,11E,17E,22Z,25E,28E,34E)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyl-2,3,10,13,16,18,19,20,24,27,30,33-dodecahydro-1H,7H-dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19, 22,25,28]decaazacyclotriacontin-5,8,11,14,17,22,25,28,31,34-decol [German] [ACD/IUPAC Name]
(5Z,8E,11E,17E,22Z,25E,28E,34E)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyl-2,3,10,13,16,18,19,20,24,27,30,33-dodecahydro-1H,7H-dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19, 22,25,28]decaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-decol [ACD/IUPAC Name]
(5Z,8E,11E,17E,22Z,25E,28E,34E)-12,29-Bis(3-aminopropyl)-6,23-dibenzyl-9,26-diisobutyl-15,32-diisopropyl-2,3,10,13,16,18,19,20,24,27,30,33-dodécahydro-1H,7H-dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19, 22,25,28]décaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-décol [French] [ACD/IUPAC Name]
1H,7H-Dipyrrolo[1,2-a:1',2'-p][1,4,7,10,13,16,19,22,25,28]decaazacyclotriacontine-5,8,11,14,17,22,25,28,31,34-decol, 12,29-bis(3-aminopropyl)-2,3,10,13,16,18,19,20,24,27,30,33-dodecahydro-15,32-bis(1- methylethyl)-9,26-bis(2-methylpropyl)-6,23-bis(phenylmethyl)-, (5Z,8E,11E,17E,22Z,25E,28E,34E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1143.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 176.6±3.0 kJ/mol
Flash Point: 645.2±34.3 °C
Index of Refraction: 1.683
Molar Refractivity: 321.6±0.4 cm3
#H bond acceptors: 22
#H bond donors: 22
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 0.01
ACD/LogD (pH 5.5): -4.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 357 Å2
Polarizability: 127.5±0.5 10-24cm3
Surface Tension: 77.1±5.0 dyne/cm
Molar Volume: 848.3±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement