ChemSpider 2D Image | Naphthol AS-BI b-D-galactopyranoside | C24H24BrNO8

Naphthol AS-BI b-D-galactopyranoside

  • Molecular FormulaC24H24BrNO8
  • Average mass534.353 Da
  • Monoisotopic mass533.068542 Da
  • ChemSpider ID166022

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-Naphthalenecarboxamide, 7-bromo-3-(β-D-galactopyranosyloxy)-N-(2-methoxyphenyl)- [ACD/Index Name]
51349-63-4 [RN]
7-Brom-3-(β-D-galactopyranosyloxy)-N-(2-methoxyphenyl)-2-naphthamid [German] [ACD/IUPAC Name]
7-Bromo-3-(β-D-galactopyranosyloxy)-N-(2-méthoxyphényl)-2-naphtamide [French] [ACD/IUPAC Name]
7-Bromo-3-(β-D-galactopyranosyloxy)-N-(2-methoxyphenyl)-2-naphthamide [ACD/IUPAC Name]
7-Bromo-N-(2-methoxyphenyl)-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-2-naphthamide
Naphthol AS-BI b-D-galactopyranoside
[51349-63-4] [RN]
1-(NAPHTHOL AS BI)-β-D-GALACTOPYRANOSIDE
7-BROMO-N-(2-METHOXYPHENYL)-3-{[(2S,3R,4S,5R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}NAPHTHALENE-2-CARBOXAMIDE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 696.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.1±3.0 kJ/mol
Flash Point: 375.1±31.5 °C
Index of Refraction: 1.709
Molar Refractivity: 128.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 12.95
ACD/KOC (pH 5.5): 217.65
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 12.95
ACD/KOC (pH 7.4): 217.64
Polar Surface Area: 138 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 329.7±3.0 cm3

Click to predict properties on the Chemicalize site


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