ChemSpider 2D Image | 1,4-Di-O-acetyl-2,6-anhydro-3-O-benzyl-5-deoxy-5-formyl-D-ribo-hex-5-enitol | C18H20O7

1,4-Di-O-acetyl-2,6-anhydro-3-O-benzyl-5-deoxy-5-formyl-D-ribo-hex-5-enitol

  • Molecular FormulaC18H20O7
  • Average mass348.347 Da
  • Monoisotopic mass348.120911 Da
  • ChemSpider ID30658998

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1,4-Di-O-acetyl-2,6-anhydro-3-O-benzyl-5-deoxy-5-formyl-D-ribo-hex-5-enitol [ACD/IUPAC Name]
1,4-Di-O-acetyl-2,6-anhydro-3-O-benzyl-5-desoxy-5-formyl-D-ribo-hex-5-enitol [German] [ACD/IUPAC Name]
1,4-Di-O-acétyl-2,6-anhydro-3-O-benzyl-5-désoxy-5-formyl-D-ribo-hex-5-énitol [French] [ACD/IUPAC Name]
D-ribo-Hex-5-enitol, 2,6-anhydro-5-deoxy-5-formyl-3-O-(phenylmethyl)-, diacetate [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 455.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 199.5±28.8 °C
Index of Refraction: 1.540
Molar Refractivity: 87.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.82
ACD/KOC (pH 5.5): 336.73
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.82
ACD/KOC (pH 7.4): 336.73
Polar Surface Area: 88 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 48.1±5.0 dyne/cm
Molar Volume: 278.5±5.0 cm3

Click to predict properties on the Chemicalize site


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