ChemSpider 2D Image | 3-Acetyl-3,5,12-trihydroxy-10-isopropoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside | C29H33NO10

3-Acetyl-3,5,12-trihydroxy-10-isopropoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside

  • Molecular FormulaC29H33NO10
  • Average mass555.573 Da
  • Monoisotopic mass555.210449 Da
  • ChemSpider ID381063

More details:

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

3-Acetyl-3,5,12-trihydroxy-10-isopropoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside [ACD/IUPAC Name]
3-Acetyl-3,5,12-trihydroxy-10-isopropoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-3-amino-2,3,6-tridesoxyhexopyranosid [German] [ACD/IUPAC Name]
3-Amino-2,3,6-tridésoxyhexopyranoside de 3-acétyl-3,5,12-trihydroxy-10-isopropoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione, 8-acetyl-10-[(3-amino-2,3,6-trideoxyhexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-(1-methylethoxy)- [ACD/Index Name]
67665-71-8 [RN]

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

NSC283161 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 773.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.2±3.0 kJ/mol
Flash Point: 421.8±32.9 °C
Index of Refraction: 1.671
Molar Refractivity: 139.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 3.80
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.23
Polar Surface Area: 186 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 80.9±5.0 dyne/cm
Molar Volume: 372.2±5.0 cm3

Click to predict properties on the Chemicalize site


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