Found 1 result

Search term: 24845982 (Found by CSID)
ChemSpider 2D Image | (2E)-1-[(9R,10S)-5,10-Dihydroxy-9-methoxy-2,2,8,8-tetramethyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-3-(4-hydroxyphenyl)-2-propen-1-one | C26H28O7

(2E)-1-[(9R,10S)-5,10-Dihydroxy-9-methoxy-2,2,8,8-tetramethyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-3-(4-hydroxyphenyl)-2-propen-1-one

  • Molecular FormulaC26H28O7
  • Average mass452.496 Da
  • Monoisotopic mass452.183502 Da
  • ChemSpider ID24845982

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2E)-1-[(9R,10S)-5,10-Dihydroxy-9-methoxy-2,2,8,8-tetramethyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-3-(4-hydroxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[(9R,10S)-5,10-Dihydroxy-9-methoxy-2,2,8,8-tetramethyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-3-(4-hydroxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[(9R,10S)-5,10-Dihydroxy-9-méthoxy-2,2,8,8-tétraméthyl-9,10-dihydro-2H,8H-pyrano[2,3-f]chromén-6-yl]-3-(4-hydroxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[(9R,10S)-9,10-dihydro-5,10-dihydroxy-9-methoxy-2,2,8,8-tetramethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-6-yl]-3-(4-hydroxyphenyl)-, (2E)- [ACD/Index Name]
Derrichalcone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 640.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 215.9±25.0 °C
Index of Refraction: 1.652
Molar Refractivity: 121.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.57
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 4036.21
ACD/KOC (pH 5.5): 13134.64
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 1086.49
ACD/KOC (pH 7.4): 3535.66
Polar Surface Area: 105 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 65.7±5.0 dyne/cm
Molar Volume: 333.6±5.0 cm3

Click to predict properties on the Chemicalize site


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