Found 1 result

Search term: QBBMNZABHFBDGG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1,4,6-Trihydroxy-8-methoxy-3-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylic acid | C17H12O8

1,4,6-Trihydroxy-8-methoxy-3-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylic acid

  • Molecular FormulaC17H12O8
  • Average mass344.272 Da
  • Monoisotopic mass344.053223 Da
  • ChemSpider ID57536205

More details:

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

1,4,6-Trihydroxy-8-methoxy-3-methyl-9,10-dioxo-9,10-dihydro-2-anthracencarbonsäure [German] [ACD/IUPAC Name]
1,4,6-Trihydroxy-8-methoxy-3-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylic acid [ACD/IUPAC Name]
2-Anthracenecarboxylic acid, 9,10-dihydro-1,4,6-trihydroxy-8-methoxy-3-methyl-9,10-dioxo- [ACD/Index Name]
Acide 1,4,6-trihydroxy-8-méthoxy-3-méthyl-9,10-dioxo-9,10-dihydro-2-anthracènecarboxylique [French] [ACD/IUPAC Name]
1,4,6-Trihydroxy-8-methoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid
1,4,6-trihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid
26071-14-7 [RN]
2-ANTHRACENECARBOXYLICACID, 9,10-DIHYDRO-1,4,6-TRIHYDROXY-8-METHOXY-3-METHYL-9,10-DIOXO-

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

Density: 1.7±0.1 g/cm3
Boiling Point: 688.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 258.2±25.0 °C
Index of Refraction: 1.731
Molar Refractivity: 82.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.92
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 1.53
ACD/KOC (pH 5.5): 5.84
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 89.9±3.0 dyne/cm
Molar Volume: 207.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement