Found 33 results

Search term: MF = 'C_{32}H_{45}NO_{6}'
ChemSpider 2D Image | (1S)-2-Acetamido-6-O-acetyl-1,5-anhydro-3,4-di-O-benzyl-2-deoxy-1-octyl-D-galactitol | C32H45NO6

(1S)-2-Acetamido-6-O-acetyl-1,5-anhydro-3,4-di-O-benzyl-2-deoxy-1-octyl-D-galactitol

  • Molecular FormulaC32H45NO6
  • Average mass539.703 Da
  • Monoisotopic mass539.324707 Da
  • ChemSpider ID8274320

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-2-Acetamido-6-O-acetyl-1,5-anhydro-3,4-di-O-benzyl-2-deoxy-1-octyl-D-galactitol [ACD/IUPAC Name]
(1S)-2-Acetamido-6-O-acetyl-1,5-anhydro-3,4-di-O-benzyl-2-desoxy-1-octyl-D-galactitol [German] [ACD/IUPAC Name]
(1S)-2-Acétamido-6-O-acétyl-1,5-anhydro-3,4-di-O-benzyl-2-désoxy-1-octyl-D-galactitol [French] [ACD/IUPAC Name]
D-Galactitol, 2-(acetylamino)-1,5-anhydro-2-deoxy-1-C-octyl-3,4-bis-O-(phenylmethyl)-, 6-acetate, (1S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 668.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 358.2±31.5 °C
Index of Refraction: 1.543
Molar Refractivity: 152.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 7.75
ACD/LogD (pH 5.5): 7.65
ACD/BCF (pH 5.5): 386555.72
ACD/KOC (pH 5.5): 347455.56
ACD/LogD (pH 7.4): 7.65
ACD/BCF (pH 7.4): 386555.72
ACD/KOC (pH 7.4): 347455.56
Polar Surface Area: 83 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 484.4±5.0 cm3

Click to predict properties on the Chemicalize site


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