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Search term: 26378460 (Found by CSID)
ChemSpider 2D Image | 1-Chloro-2,4-dihydroxy-7-(hydroxymethyl)-5-methoxy-9,10-anthraquinone | C16H11ClO6

1-Chloro-2,4-dihydroxy-7-(hydroxymethyl)-5-methoxy-9,10-anthraquinone

  • Molecular FormulaC16H11ClO6
  • Average mass334.708 Da
  • Monoisotopic mass334.024414 Da
  • ChemSpider ID26378460

More details:

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

1-Chlor-2,4-dihydroxy-7-(hydroxymethyl)-5-methoxy-9,10-anthrachinon [German] [ACD/IUPAC Name]
1-Chloro-2,4-dihydroxy-7-(hydroxymethyl)-5-methoxy-9,10-anthraquinone [ACD/IUPAC Name]
1-Chloro-2,4-dihydroxy-7-(hydroxyméthyl)-5-méthoxy-9,10-anthraquinone [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 1-chloro-2,4-dihydroxy-7-(hydroxymethyl)-5-methoxy- [ACD/Index Name]
5-chloro-ω-hydroxy-1-O-methylemodin

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

Density: 1.6±0.1 g/cm3
Boiling Point: 627.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 333.3±31.5 °C
Index of Refraction: 1.711
Molar Refractivity: 80.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 80.45
ACD/KOC (pH 5.5): 569.47
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.19
Polar Surface Area: 104 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 80.6±3.0 dyne/cm
Molar Volume: 205.7±3.0 cm3

Click to predict properties on the Chemicalize site


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