ChemSpider 2D Image | (14Z)-6-(4-Hydroxy-3-iodobenzyl)-3-isopropyl-7,9,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone | C30H44IN3O6

(14Z)-6-(4-Hydroxy-3-iodobenzyl)-3-isopropyl-7,9,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone

  • Molecular FormulaC30H44IN3O6
  • Average mass669.591 Da
  • Monoisotopic mass669.227478 Da
  • ChemSpider ID57641937

  • Double-bond stereo - Double-bond stereo

More details:

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

(14Z)-6-(4-Hydroxy-3-iodbenzyl)-3-isopropyl-7,9,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-en-2,5,8,11-tetron [German] [ACD/IUPAC Name]
(14Z)-6-(4-Hydroxy-3-iodobenzyl)-3-isopropyl-7,9,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone [ACD/IUPAC Name]
(14Z)-6-(4-Hydroxy-3-iodobenzyl)-3-isopropyl-7,9,12,14,16,18-hexaméthyl-1-oxa-4,7,10-triazacyclooctadéc-14-ène-2,5,8,11-tétrone [French] [ACD/IUPAC Name]
1-Oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone, 6-[(4-hydroxy-3-iodophenyl)methyl]-7,9,12,14,16,18-hexamethyl-3-(1-methylethyl)-, (14Z)- [ACD/Index Name]
157207-91-5 [RN]
geodiamolide TA

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

Density: 1.2±0.1 g/cm3
Boiling Point: 815.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.6±3.0 kJ/mol
Flash Point: 446.9±34.3 °C
Index of Refraction: 1.512
Molar Refractivity: 162.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 277.07
ACD/KOC (pH 5.5): 1949.31
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 255.27
ACD/KOC (pH 7.4): 1795.90
Polar Surface Area: 125 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 35.1±3.0 dyne/cm
Molar Volume: 541.6±3.0 cm3

Click to predict properties on the Chemicalize site


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