Found 1 result

Search term: 78445655 (Found by CSID)
ChemSpider 2D Image | 5,9,13-Triethyl-14-oxoazacyclotetradecan-6-yl 3-amino-3,6-dideoxy-2-O-alpha-D-glucopyranosyl-alpha-D-mannopyranoside | C31H58N2O10

5,9,13-Triethyl-14-oxoazacyclotetradecan-6-yl 3-amino-3,6-dideoxy-2-O-α-D-glucopyranosyl-α-D-mannopyranoside

  • Molecular FormulaC31H58N2O10
  • Average mass618.800 Da
  • Monoisotopic mass618.409119 Da
  • ChemSpider ID78445655

  • defined stereocentres - 10 of 14 defined stereocentres

More details:

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

3-Amino-3,6-didésoxy-2-O-α-D-glucopyranosyl-α-D-mannopyranoside de 5,9,13-triéthyl-14-oxoazacyclotétradécan-6-yle [French] [ACD/IUPAC Name]
5,9,13-Triethyl-14-oxoazacyclotetradecan-6-yl 3-amino-3,6-dideoxy-2-O-α-D-glucopyranosyl-α-D-mannopyranoside [ACD/IUPAC Name]
5,9,13-Triethyl-14-oxoazacyclotetradecan-6-yl-3-amino-3,6-didesoxy-2-O-α-D-glucopyranosyl-α-D-mannopyranosid [German] [ACD/IUPAC Name]
Azacyclotetradecan-2-one, 10-[(3-amino-3,6-dideoxy-2-O-α-D-glucopyranosyl-α-D-mannopyranosyl)oxy]-3,7,11-triethyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 804.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.5 mmHg at 25°C
Enthalpy of Vaporization: 133.2±6.0 kJ/mol
Flash Point: 440.4±34.3 °C
Index of Refraction: 1.551
Molar Refractivity: 161.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 2.35
ACD/LogD (pH 5.5): -0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.75
ACD/BCF (pH 7.4): 1.57
ACD/KOC (pH 7.4): 32.02
Polar Surface Area: 193 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 505.3±5.0 cm3

Click to predict properties on the Chemicalize site


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