ChemSpider 2D Image | N-[(Z)-(3-{(4R,5R)-4,5-Bis[methoxy(diphenyl)methyl]-1,3,2-dioxaborolan-2-yl}-2-furyl)methylene]-4-methylbenzenesulfonamide | C42H38BNO7S

N-[(Z)-(3-{(4R,5R)-4,5-Bis[methoxy(diphenyl)methyl]-1,3,2-dioxaborolan-2-yl}-2-furyl)methylene]-4-methylbenzenesulfonamide

  • Molecular FormulaC42H38BNO7S
  • Average mass711.630 Da
  • Monoisotopic mass711.246216 Da
  • ChemSpider ID9506468

  • 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

Benzenesulfonamide, N-[(1Z)-[3-[(4R,5R)-4,5-bis(methoxydiphenylmethyl)-1,3,2-dioxaborolan-2-yl]-2-furanyl]methylene]-4-methyl- [ACD/Index Name]
N-[(Z)-(3-{(4R,5R)-4,5-Bis[methoxy(diphenyl)methyl]-1,3,2-dioxaborolan-2-yl}-2-furyl)methylen]-4-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-[(Z)-(3-{(4R,5R)-4,5-Bis[methoxy(diphenyl)methyl]-1,3,2-dioxaborolan-2-yl}-2-furyl)methylene]-4-methylbenzenesulfonamide [ACD/IUPAC Name]
N-[(Z)-(3-{(4R,5R)-4,5-Bis[méthoxy(diphényl)méthyl]-1,3,2-dioxaborolan-2-yl}-2-furyl)méthylène]-4-méthylbenzènesulfonamide [French] [ACD/IUPAC 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: 807.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 113.4±3.0 kJ/mol
Flash Point: 442.4±37.1 °C
Index of Refraction: 1.596
Molar Refractivity: 203.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 105 Å2
Polarizability: 80.6±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 597.9±7.0 cm3

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