ChemSpider 2D Image | (1R,3S,5S,6R,8S,10S,11R,13S,15S,16R,18S,20S,21R,23S,25S,26S,27R,28S,29R,30S,31R,32S,33R,34S,35R)-5,10,15,20,25-Pentamethyl-2,4,7,9,12,14,17,19,22,24-decaoxahexacyclo[21.2.2.2~3,6~.2~8,11~.2~13,16~.2~1 8,21~]pentatriacontane-26,27,28,29,30,31,32,33,34,35-decol | C30H50O20

(1R,3S,5S,6R,8S,10S,11R,13S,15S,16R,18S,20S,21R,23S,25S,26S,27R,28S,29R,30S,31R,32S,33R,34S,35R)-5,10,15,20,25-Pentamethyl-2,4,7,9,12,14,17,19,22,24-decaoxahexacyclo[21.2.2.23,6.28,11.213,16.21 8,21]pentatriacontane-26,27,28,29,30,31,32,33,34,35-decol

  • Molecular FormulaC30H50O20
  • Average mass730.706 Da
  • Monoisotopic mass730.289551 Da
  • ChemSpider ID165827

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

(1R,3S,5S,6R,8S,10S,11R,13S,15S,16R,18S,20S,21R,23S,25S,26S,27R,28S,29R,30S,31R,32S,33R,34S,35R)-5,10,15,20,25-Pentamethyl-2,4,7,9,12,14,17,19,22,24-decaoxahexacyclo[21.2.2.23,6.28,11.213,16.21 8,21]pentatriacontan-26,27,28,29,30,31,32,33,34,35-decol [German] [ACD/IUPAC Name]
(1R,3S,5S,6R,8S,10S,11R,13S,15S,16R,18S,20S,21R,23S,25S,26S,27R,28S,29R,30S,31R,32S,33R,34S,35R)-5,10,15,20,25-Pentamethyl-2,4,7,9,12,14,17,19,22,24-decaoxahexacyclo[21.2.2.23,6.28,11.213,16.21 8,21]pentatriacontane-26,27,28,29,30,31,32,33,34,35-decol [ACD/IUPAC Name]
(1R,3S,5S,6R,8S,10S,11R,13S,15S,16R,18S,20S,21R,23S,25S,26S,27R,28S,29R,30S,31R,32S,33R,34S,35R)-5,10,15,20,25-Pentaméthyl-2,4,7,9,12,14,17,19,22,24-décaoxahexacyclo[21.2.2.23,6.28,11.213,16.21 8,21]pentatriacontane-26,27,28,29,30,31,32,33,34,35-décol [French] [ACD/IUPAC Name]
159495-25-7 [RN]
Cyclorhamnopentaose
Cyclo-rhamnopentaose

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1045.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 173.2±6.0 kJ/mol
Flash Point: 586.2±32.9 °C
Index of Refraction: 1.549
Molar Refractivity: 161.1±0.3 cm3
#H bond acceptors: 20
#H bond donors: 10
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 3
ACD/LogP: -0.56
ACD/LogD (pH 5.5): -1.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.47
ACD/LogD (pH 7.4): -1.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.47
Polar Surface Area: 295 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 506.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement