ChemSpider 2D Image | N-(5,6-Dimethoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-methyl-3-nitrobenzamide | C18H17N3O5S

N-(5,6-Dimethoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-methyl-3-nitrobenzamide

  • Molecular FormulaC18H17N3O5S
  • Average mass387.410 Da
  • Monoisotopic mass387.088898 Da
  • ChemSpider ID39309961

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-(5,6-dimethoxy-3-methyl-2(3H)-benzothiazolylidene)-2-methyl-3-nitro- [ACD/Index Name]
N-(5,6-Dimethoxy-3-methyl-1,3-benzothiazol-2(3H)-yliden)-2-methyl-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-(5,6-Dimethoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-methyl-3-nitrobenzamide [ACD/IUPAC Name]
N-(5,6-Diméthoxy-3-méthyl-1,3-benzothiazol-2(3H)-ylidène)-2-méthyl-3-nitrobenzamide [French] [ACD/IUPAC Name]
N-(5,6-dimethoxy-3-methylbenzo[d]thiazol-2(3H)-ylidene)-2-methyl-3-nitrobenzamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 581.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 305.3±32.9 °C
Index of Refraction: 1.646
Molar Refractivity: 101.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 180.61
ACD/KOC (pH 5.5): 1435.41
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 180.61
ACD/KOC (pH 7.4): 1435.41
Polar Surface Area: 122 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 278.9±7.0 cm3

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