ChemSpider 2D Image | Dauricine | C38H44N2O6

Dauricine

  • Molecular FormulaC38H44N2O6
  • Average mass624.766 Da
  • Monoisotopic mass624.319946 Da
  • ChemSpider ID205223

More details:

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

4-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isochinolinyl)methyl]-2-{4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isochinolinyl)methyl]phenoxy}phenol [German] [ACD/IUPAC Name]
4-[(6,7-Diméthoxy-2-méthyl-1,2,3,4-tétrahydro-1-isoquinoléinyl)méthyl]-2-{4-[(6,7-diméthoxy-2-méthyl-1,2,3,4-tétrahydro-1-isoquinoléinyl)méthyl]phénoxy}phénol [French] [ACD/IUPAC Name]
4-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-2-{4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]phenoxy}phenol [ACD/IUPAC Name]
4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-{4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]phenoxy}phenol
Dauricine
Phenol, 4-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]-2-[4-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]phenoxy]- [ACD/Index Name]
4-[(6,7-Dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol
5548-68-5 [RN]
8QTO90G5W5
MFCD26960929 [MDL number]
More...

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

C09419 [DBID]
NCI60_003351 [DBID]
NSC36413 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 712.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 384.6±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 180.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.61
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 1.17
ACD/KOC (pH 5.5): 2.91
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 783.60
ACD/KOC (pH 7.4): 1940.78
Polar Surface Area: 73 Å2
Polarizability: 71.6±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 526.8±3.0 cm3

Click to predict properties on the Chemicalize site


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