ChemSpider 2D Image | (1S)-1,5-Anhydro-2,3,4,6-tetra-O-benzyl-1-(3-carboxypropyl)-D-galactitol | C38H42O7

(1S)-1,5-Anhydro-2,3,4,6-tetra-O-benzyl-1-(3-carboxypropyl)-D-galactitol

  • Molecular FormulaC38H42O7
  • Average mass610.736 Da
  • Monoisotopic mass610.293030 Da
  • ChemSpider ID8874318

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-2,3,4,6-tetra-O-benzyl-1-(3-carboxypropyl)-D-galactitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2,3,4,6-tetra-O-benzyl-1-(3-carboxypropyl)-D-galactitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2,3,4,6-tétra-O-benzyl-1-(3-carboxypropyl)-D-galactitol [French] [ACD/IUPAC Name]
D-glycero-L-manno-Deconic acid, 5,9-anhydro-2,3,4-trideoxy-6,7,8,10-tetrakis-O-(phenylmethyl)- [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: 738.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.1±3.0 kJ/mol
Flash Point: 226.9±26.4 °C
Index of Refraction: 1.607
Molar Refractivity: 173.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 8.78
ACD/LogD (pH 5.5): 6.94
ACD/BCF (pH 5.5): 70898.17
ACD/KOC (pH 5.5): 60923.23
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 1134.91
ACD/KOC (pH 7.4): 975.23
Polar Surface Area: 83 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 503.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement