Found 2 results

Search term: LBTVHXHERHESKG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1,7-Bis{4-hydroxy-3-[(~2~H_3_)methyloxy]phenyl}-3,5-heptanedione | C21H18D6O6

1,7-Bis{4-hydroxy-3-[(2H3)methyloxy]phenyl}-3,5-heptanedione

  • Molecular FormulaC21H18D6O6
  • Average mass378.449 Da
  • Monoisotopic mass378.194946 Da
  • ChemSpider ID58794623

  • Non-standard isotope - Non-standard isotope

More details:

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

1,7-Bis{4-hydroxy-3-[(2H3)methyloxy]phenyl}-3,5-heptandion [German] [ACD/IUPAC Name]
1,7-Bis{4-hydroxy-3-[(2H3)methyloxy]phenyl}-3,5-heptanedione [ACD/IUPAC Name]
1,7-Bis{4-hydroxy-3-[(2H3)méthyloxy]phényl}-3,5-heptanedione [French] [ACD/IUPAC Name]
3,5-Heptanedione, 1,7-bis[4-hydroxy-3-(methyl-d3-oxy)phenyl]- [ACD/Index Name]
1,7-bis[4-hydroxy-3-(trideuteriomethoxy)phenyl]heptane-3,5-dione
1794898-13-7 [RN]
Tetrahydrocurcumin D6

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

Density: 1.2±0.1 g/cm3
Boiling Point: 564.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 196.2±22.2 °C
Index of Refraction: 1.575
Molar Refractivity: 100.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.56
ACD/KOC (pH 5.5): 439.45
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 33.71
ACD/KOC (pH 7.4): 428.55
Polar Surface Area: 93 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 304.6±3.0 cm3

Click to predict properties on the Chemicalize site


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