ChemSpider 2D Image | 7-Chloro-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside | C14H16ClNO9

7-Chloro-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside

  • Molecular FormulaC14H16ClNO9
  • Average mass377.731 Da
  • Monoisotopic mass377.051361 Da
  • ChemSpider ID20057039

More details:

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

2H-1,4-Benzoxazin-3(4H)-one, 7-chloro-2-(hexopyranosyloxy)-4-hydroxy- [ACD/Index Name]
7-Chlor-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylhexopyranosid [German] [ACD/IUPAC Name]
7-Chloro-4-hydroxy-2-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-4H-benzo[1,4]oxazin-3-one
7-Chloro-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside [ACD/IUPAC Name]
Hexopyranoside de 7-chloro-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yle [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 678.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 364.2±34.3 °C
Index of Refraction: 1.714
Molar Refractivity: 81.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -2.18
ACD/LogD (pH 5.5): -1.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.78
ACD/LogD (pH 7.4): -2.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.26
Polar Surface Area: 149 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 107.0±5.0 dyne/cm
Molar Volume: 207.0±5.0 cm3

Click to predict properties on the Chemicalize site


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