Found 1 result

Search term: LIPOZEOJCWLAFC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl (2E)-4-{1,5-dihydroxy-7-methoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydro-2-anthracenyl}-3-methoxy-2-butenoate | C29H30O11

Methyl (2E)-4-{1,5-dihydroxy-7-methoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydro-2-anthracenyl}-3-methoxy-2-butenoate

  • Molecular FormulaC29H30O11
  • Average mass554.542 Da
  • Monoisotopic mass554.178833 Da
  • ChemSpider ID9975541

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-4-{1,5-Dihydroxy-7-méthoxy-3-[4-(2-méthyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydro-2-anthracényl}-3-méthoxy-2-buténoate de méthyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 4-[9,10-dihydro-1,5-dihydroxy-7-methoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-2-anthracenyl]-3-methoxy-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-4-{1,5-dihydroxy-7-methoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydro-2-anthracenyl}-3-methoxy-2-butenoate [ACD/IUPAC Name]
Methyl-(2E)-4-{1,5-dihydroxy-7-methoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydro-2-anthracenyl}-3-methoxy-2-butenoat [German] [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: 783.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.0±3.0 kJ/mol
Flash Point: 257.8±26.4 °C
Index of Refraction: 1.594
Molar Refractivity: 139.1±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 349.35
ACD/KOC (pH 5.5): 1982.93
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 1.60
ACD/KOC (pH 7.4): 9.10
Polar Surface Area: 155 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 410.2±3.0 cm3

Click to predict properties on the Chemicalize site


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