ChemSpider 2D Image | 7-Chloro-N-(3,4-difluorobenzyl)-1,3-benzothiazol-2-amine | C14H9ClF2N2S

7-Chloro-N-(3,4-difluorobenzyl)-1,3-benzothiazol-2-amine

  • Molecular FormulaC14H9ClF2N2S
  • Average mass310.750 Da
  • Monoisotopic mass310.014313 Da
  • ChemSpider ID43170762

More details:

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

2-Benzothiazolamine, 7-chloro-N-[(3,4-difluorophenyl)methyl]- [ACD/Index Name]
7-Chlor-N-(3,4-difluorbenzyl)-1,3-benzothiazol-2-amin [German] [ACD/IUPAC Name]
7-Chloro-N-(3,4-difluorobenzyl)-1,3-benzothiazol-2-amine [ACD/IUPAC Name]
7-Chloro-N-(3,4-difluorobenzyl)-1,3-benzothiazol-2-amine [French] [ACD/IUPAC 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: 435.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.4±31.5 °C
Index of Refraction: 1.696
Molar Refractivity: 79.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 4.78
ACD/BCF (pH 5.5): 2523.90
ACD/KOC (pH 5.5): 9479.31
ACD/LogD (pH 7.4): 4.78
ACD/BCF (pH 7.4): 2524.33
ACD/KOC (pH 7.4): 9480.96
Polar Surface Area: 53 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 206.8±3.0 cm3

Click to predict properties on the Chemicalize site


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