ChemSpider 2D Image | ME-344 | C22H20O4

ME-344

  • Molecular FormulaC22H20O4
  • Average mass348.392 Da
  • Monoisotopic mass348.136169 Da
  • ChemSpider ID32698441

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4S)-3,4-Bis(4-hydroxyphenyl)-8-methyl-7-chromanol [ACD/IUPAC Name]
(3R,4S)-3,4-Bis(4-hydroxyphenyl)-8-methyl-7-chromanol [German] [ACD/IUPAC Name]
(3R,4S)-3,4-Bis(4-hydroxyphényl)-8-méthyl-7-chromanol [French] [ACD/IUPAC Name]
1374524-68-1 [RN]
2H-1-Benzopyran-7-ol, 3,4-dihydro-3,4-bis(4-hydroxyphenyl)-8-methyl-, (3R,4S)- [ACD/Index Name]
843G0TDV51
ME-344
(3R,4S)-3,4-bis(4-hydroxyphenyl)-8-methyl-3,4-dihydro-2H-chromen-7-ol
4,4'-((3R,4S)-7-Hydroxy-8-methylchroman-3,4-diyl)diphenol
UNII:843G0TDV51
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 534.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 277.3±30.1 °C
Index of Refraction: 1.666
Molar Refractivity: 99.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 618.28
ACD/KOC (pH 5.5): 3463.57
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 614.29
ACD/KOC (pH 7.4): 3441.22
Polar Surface Area: 70 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 267.2±3.0 cm3

Click to predict properties on the Chemicalize site


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