ChemSpider 2D Image | rubitecan | C20H15N3O6

rubitecan

  • Molecular FormulaC20H15N3O6
  • Average mass393.350 Da
  • Monoisotopic mass393.096100 Da
  • ChemSpider ID10608493

More details:

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

19-ethyl-19-hydroxy-8-nitro-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0?,?.0¹?,²?]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-10-nitro- [ACD/Index Name]
4-Ethyl-4-hydroxy-10-nitro-1H-pyrano[3',4':6,7]indolizino[1,2-b]chinolin-3,14(4H,12H)-dion [German] [ACD/IUPAC Name]
4-Éthyl-4-hydroxy-10-nitro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoléine-3,14(4H,12H)-dione [French] [ACD/IUPAC Name]
4-Ethyl-4-hydroxy-10-nitro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione [ACD/IUPAC Name]
rubitecan [INN] [USAN] [Wiki]
(20S)-4-Ethyl-4-hydroxy-10-nitro-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione
(S)-4-Ethyl-4-hydroxy-10-nitro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
104195-61-1 [RN]
10-Nitro camptothecin
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

D04031 [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: 816.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.4±3.0 kJ/mol
Flash Point: 447.5±34.3 °C
Index of Refraction: 1.762
Molar Refractivity: 99.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.25
ACD/KOC (pH 5.5): 209.15
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.26
ACD/KOC (pH 7.4): 209.32
Polar Surface Area: 126 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 91.4±5.0 dyne/cm
Molar Volume: 241.3±5.0 cm3

Click to predict properties on the Chemicalize site


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