Found 2 results

Search term: YAAGNRWEJSZFLV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (4S)-2-(3,4-Dihydroxyphenyl)-4H-chromene-3,4,5,7-tetrol | C15H12O7

(4S)-2-(3,4-Dihydroxyphenyl)-4H-chromene-3,4,5,7-tetrol

  • Molecular FormulaC15H12O7
  • Average mass304.252 Da
  • Monoisotopic mass304.058289 Da
  • ChemSpider ID58837337

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-2-(3,4-Dihydroxyphenyl)-4H-chromen-3,4,5,7-tetrol [German] [ACD/IUPAC Name]
(4S)-2-(3,4-Dihydroxyphenyl)-4H-chromene-3,4,5,7-tetrol [ACD/IUPAC Name]
(4S)-2-(3,4-Dihydroxyphényl)-4H-chromène-3,4,5,7-tétrol [French] [ACD/IUPAC Name]
4H-1-Benzopyran-3,4,5,7-tetrol, 2-(3,4-dihydroxyphenyl)-, (4S)- [ACD/Index Name]
(4S)-2,3-dehydro-leucocyanidin
(4S)-2-(3,4-dihydroxyphenyl)-4H-1-benzopyran-3,4,5,7-tetrol
(4S)-2,3-dehydroleucocyanidin

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

Density: 1.8±0.1 g/cm3
Boiling Point: 678.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 364.1±31.5 °C
Index of Refraction: 1.842
Molar Refractivity: 74.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 4.56
ACD/KOC (pH 5.5): 103.01
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.20
ACD/KOC (pH 7.4): 95.04
Polar Surface Area: 131 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 121.9±3.0 dyne/cm
Molar Volume: 168.5±3.0 cm3

Click to predict properties on the Chemicalize site


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