ChemSpider 2D Image | Butyl [4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinate | C22H32NO6P

Butyl [4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinate

  • Molecular FormulaC22H32NO6P
  • Average mass437.466 Da
  • Monoisotopic mass437.196716 Da
  • ChemSpider ID62646913

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(R)-[4-(Diméthylamino)phényl][(R)-hydroxy(3,4,5-triméthoxyphényl)méthyl]phosphinate de butyle [French] [ACD/IUPAC Name]
[4-(Diméthylamino)phényl][(R)-hydroxy(3,4,5-triméthoxyphényl)méthyl]phosphinate de butyle [French] [ACD/IUPAC Name]
Butyl (R)-[4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinate [ACD/IUPAC Name]
Butyl [4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinate [ACD/IUPAC Name]
Butyl-(R)-[4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinat [German] [ACD/IUPAC Name]
Butyl-[4-(dimethylamino)phenyl][(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]phosphinat [German] [ACD/IUPAC Name]
Phosphinic acid, P-[4-(dimethylamino)phenyl]-P-[(1R,R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]-, butyl ester, (R)- [ACD/Index Name]
Phosphinic acid, P-[4-(dimethylamino)phenyl]-P-[(R)-hydroxy(3,4,5-trimethoxyphenyl)methyl]-, butyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 564.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 295.2±32.9 °C
Index of Refraction: 1.552
Molar Refractivity: 116.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.76
ACD/KOC (pH 5.5): 562.19
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.79
ACD/KOC (pH 7.4): 562.53
Polar Surface Area: 87 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 48.4±5.0 dyne/cm
Molar Volume: 365.8±5.0 cm3

Click to predict properties on the Chemicalize site


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