ChemSpider 2D Image | N-{[(2E)-2-(3-Chlorobenzylidene)hydrazino]carbonothioyl}-beta-D-glucopyranosylamine | C14H18ClN3O5S

N-{[(2E)-2-(3-Chlorobenzylidene)hydrazino]carbonothioyl}-β-D-glucopyranosylamine

  • Molecular FormulaC14H18ClN3O5S
  • Average mass375.828 Da
  • Monoisotopic mass375.065582 Da
  • ChemSpider ID25057962

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

N-({(2e)-2-[(3-Chlorophenyl)methylidene]hydrazino}carbonothioyl)-β-D-Glucopyranosylamine
N-{[(2E)-2-(3-Chlorbenzyliden)hydrazino]carbonothioyl}-β-D-glucopyranosylamin [German] [ACD/IUPAC Name]
N-{[(2E)-2-(3-Chlorobenzylidene)hydrazino]carbonothioyl}-β-D-glucopyranosylamine [ACD/IUPAC Name]
N-{[(2E)-2-(3-Chlorobenzylidène)hydrazino]carbonothioyl}-β-D-glucopyranosylamine [French] [ACD/IUPAC Name]
β-D-Glucopyranosylamine, N-[[(2E)-2-[(3-chlorophenyl)methylene]hydrazinyl]thioxomethyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 606.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 320.7±34.3 °C
Index of Refraction: 1.694
Molar Refractivity: 87.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.61
ACD/KOC (pH 5.5): 103.94
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.61
ACD/KOC (pH 7.4): 103.85
Polar Surface Area: 159 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 62.9±7.0 dyne/cm
Molar Volume: 228.7±7.0 cm3

Click to predict properties on the Chemicalize site


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