ChemSpider 2D Image | N-(3-Ethyl-4,6-difluoro-1,3-benzothiazol-2(3H)-ylidene)cyclopropanecarboxamide | C13H12F2N2OS

N-(3-Ethyl-4,6-difluoro-1,3-benzothiazol-2(3H)-ylidene)cyclopropanecarboxamide

  • Molecular FormulaC13H12F2N2OS
  • Average mass282.309 Da
  • Monoisotopic mass282.063843 Da
  • ChemSpider ID35316205

More details:

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

Cyclopropanecarboxamide, N-(3-ethyl-4,6-difluoro-2(3H)-benzothiazolylidene)- [ACD/Index Name]
N-(3-Ethyl-4,6-difluor-1,3-benzothiazol-2(3H)-yliden)cyclopropancarboxamid [German] [ACD/IUPAC Name]
N-(3-Ethyl-4,6-difluoro-1,3-benzothiazol-2(3H)-ylidene)cyclopropanecarboxamide [ACD/IUPAC Name]
N-(3-Éthyl-4,6-difluoro-1,3-benzothiazol-2(3H)-ylidène)cyclopropanecarboxamide [French] [ACD/IUPAC Name]
868375-35-3 [RN]
N-[(2Z)-3-ethyl-4,6-difluoro-2,3-dihydro-1,3-benzothiazol-2-ylidene]cyclopropanecarboxamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 388.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 189.0±30.7 °C
Index of Refraction: 1.665
Molar Refractivity: 70.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 153.99
ACD/KOC (pH 5.5): 1280.61
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 153.99
ACD/KOC (pH 7.4): 1280.61
Polar Surface Area: 58 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 47.0±7.0 dyne/cm
Molar Volume: 188.6±7.0 cm3

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