ChemSpider 2D Image | (3Z)-3-[1-(Methoxyamino)ethylidene]-8-methyl-2,4-dioxo-3,4-dihydro-2H-chromen-7-yl 6-deoxy-5-ethyl-4-O-methyl-3-O-[(2-propyn-1-yloxy)carbamoyl]hexopyranoside | C26H32N2O11

(3Z)-3-[1-(Methoxyamino)ethylidene]-8-methyl-2,4-dioxo-3,4-dihydro-2H-chromen-7-yl 6-deoxy-5-ethyl-4-O-methyl-3-O-[(2-propyn-1-yloxy)carbamoyl]hexopyranoside

  • Molecular FormulaC26H32N2O11
  • Average mass548.539 Da
  • Monoisotopic mass548.200623 Da
  • ChemSpider ID8091128

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-3-[1-(Methoxyamino)ethyliden]-8-methyl-2,4-dioxo-3,4-dihydro-2H-chromen-7-yl-6-desoxy-5-ethyl-4-O-methyl-3-O-[(2-propin-1-yloxy)carbamoyl]hexopyranosid [German] [ACD/IUPAC Name]
(3Z)-3-[1-(Methoxyamino)ethylidene]-8-methyl-2,4-dioxo-3,4-dihydro-2H-chromen-7-yl 6-deoxy-5-ethyl-4-O-methyl-3-O-[(2-propyn-1-yloxy)carbamoyl]hexopyranoside [ACD/IUPAC Name]
2H-1-Benzopyran-2,4(3H)-dione, 7-[[6,7-dideoxy-5-C-methyl-4-O-methyl-3-O-[[(2-propyn-1-yloxy)amino]carbonyl]heptopyranosyl]oxy]-3-[1-(methoxyamino)ethylidene]-8-methyl-, (3Z)- [ACD/Index Name]
6-Désoxy-5-éthyl-4-O-méthyl-3-O-[(2-propyn-1-yloxy)carbamoyl]hexopyranoside de (3Z)-3-[1-(méthoxyamino)éthylidène]-8-méthyl-2,4-dioxo-3,4-dihydro-2H-chromén-7-yle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.578
Molar Refractivity: 133.8±0.4 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.63
ACD/KOC (pH 5.5): 374.42
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.63
ACD/KOC (pH 7.4): 374.41
Polar Surface Area: 160 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 59.6±5.0 dyne/cm
Molar Volume: 403.0±5.0 cm3

Click to predict properties on the Chemicalize site


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