ChemSpider 2D Image | 3,5,12-Trihydroxy-3-(hydroxymethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside | C26H29NO10

3,5,12-Trihydroxy-3-(hydroxymethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside

  • Molecular FormulaC26H29NO10
  • Average mass515.509 Da
  • Monoisotopic mass515.179138 Da
  • ChemSpider ID380607

More details:

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

3,5,12-Trihydroxy-3-(hydroxymethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside [ACD/IUPAC Name]
3,5,12-Trihydroxy-3-(hydroxymethyl)-10-methoxy-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 3,5,12-trihydroxy-3-(hydroxyméthyl)-10-méthoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxyhexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxymethyl)-1-methoxy- [ACD/Index Name]
73068-98-1 [RN]

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

NSC272681 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 774.1±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: 422.0±32.9 °C
Index of Refraction: 1.712
Molar Refractivity: 126.8±0.4 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 2.64
ACD/LogD (pH 5.5): -1.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.74
Polar Surface Area: 189 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 94.5±5.0 dyne/cm
Molar Volume: 323.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement