ChemSpider 2D Image | 2-(1,3-Benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid | C16H14N4O2S

2-(1,3-Benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid

  • Molecular FormulaC16H14N4O2S
  • Average mass326.373 Da
  • Monoisotopic mass326.083740 Da
  • ChemSpider ID23353284

More details:

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

2-(1,3-Benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoesäure [German] [ACD/IUPAC Name]
2-(1,3-Benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid [ACD/IUPAC Name]
Acide 2-(1,3-benzothiazol-2-yldiazényl)-5-(diméthylamino)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[2-(2-benzothiazolyl)diazenyl]-5-(dimethylamino)- [ACD/Index Name]
83688-78-2 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 563.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 294.4±32.9 °C
Index of Refraction: 1.693
Molar Refractivity: 90.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.57
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 75.69
ACD/KOC (pH 5.5): 279.44
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 2.86
ACD/KOC (pH 7.4): 10.56
Polar Surface Area: 106 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 236.9±7.0 cm3

Click to predict properties on the Chemicalize site


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