ChemSpider 2D Image | 7-Chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside | C14H16ClNO8

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

  • Molecular FormulaC14H16ClNO8
  • Average mass361.732 Da
  • Monoisotopic mass361.056458 Da
  • ChemSpider ID20479222

More details:

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

2H-1,4-Benzoxazin-3(4H)-one, 7-chloro-2-(hexopyranosyloxy)- [ACD/Index Name]
7-Chlor-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylhexopyranosid [German] [ACD/IUPAC Name]
7-Chloro-2-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-4H-benzo[1,4]oxazin-3-one
7-Chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside [ACD/IUPAC Name]
Hexopyranoside de 7-chloro-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: 1.7±0.1 g/cm3
Boiling Point: 667.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 357.2±31.5 °C
Index of Refraction: 1.678
Molar Refractivity: 79.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.71
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.71
Polar Surface Area: 138 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 90.7±5.0 dyne/cm
Molar Volume: 210.9±5.0 cm3

Click to predict properties on the Chemicalize site


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