ChemSpider 2D Image | (4Z)-6-Bromo-1-methyl-4-[(2E)-(4-methylbenzylidene)hydrazono]-3,4-dihydro-1H-2,1-benzothiazine 2,2-dioxide | C17H16BrN3O2S

(4Z)-6-Bromo-1-methyl-4-[(2E)-(4-methylbenzylidene)hydrazono]-3,4-dihydro-1H-2,1-benzothiazine 2,2-dioxide

  • Molecular FormulaC17H16BrN3O2S
  • Average mass406.297 Da
  • Monoisotopic mass405.014648 Da
  • ChemSpider ID30656872

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z)-6-Brom-1-methyl-4-[(2E)-(4-methylbenzyliden)hydrazono]-3,4-dihydro-1H-2,1-benzothiazin-2,2-dioxid [German] [ACD/IUPAC Name]
(4Z)-6-Bromo-1-methyl-4-[(2E)-(4-methylbenzylidene)hydrazono]-3,4-dihydro-1H-2,1-benzothiazine 2,2-dioxide [ACD/IUPAC Name]
2,2-Dioxyde de (4Z)-6-bromo-1-méthyl-4-[(2E)-(4-méthylbenzylidène)hydrazono]-3,4-dihydro-1H-2,1-benzothiazine [French] [ACD/IUPAC Name]
Benzaldehyde, 4-methyl-, 2-[(4Z)-6-bromo-1-methyl-2,2-dioxido-1H-2,1-benzothiazin-4(3H)-ylidene]hydrazone [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 555.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 289.7±32.9 °C
Index of Refraction: 1.659
Molar Refractivity: 100.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 667.36
ACD/KOC (pH 5.5): 3539.08
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 748.73
ACD/KOC (pH 7.4): 3970.54
Polar Surface Area: 70 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 272.0±7.0 cm3

Click to predict properties on the Chemicalize site


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