ChemSpider 2D Image | 2-({[4-(1,3-Benzothiazol-2-yl)phenyl]amino}methyl)phenol | C20H16N2OS

2-({[4-(1,3-Benzothiazol-2-yl)phenyl]amino}methyl)phenol

  • Molecular FormulaC20H16N2OS
  • Average mass332.419 Da
  • Monoisotopic mass332.098328 Da
  • ChemSpider ID30657318

More details:

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

2-({[4-(1,3-Benzothiazol-2-yl)phenyl]amino}methyl)phenol [German] [ACD/IUPAC Name]
2-({[4-(1,3-Benzothiazol-2-yl)phenyl]amino}methyl)phenol [ACD/IUPAC Name]
2-({[4-(1,3-Benzothiazol-2-yl)phényl]amino}méthyl)phénol [French] [ACD/IUPAC Name]
Phenol, 2-[[[4-(2-benzothiazolyl)phenyl]amino]methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 543.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 282.7±32.9 °C
Index of Refraction: 1.743
Molar Refractivity: 101.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 4.58
ACD/BCF (pH 5.5): 1789.81
ACD/KOC (pH 5.5): 7411.60
ACD/LogD (pH 7.4): 4.58
ACD/BCF (pH 7.4): 1780.43
ACD/KOC (pH 7.4): 7372.75
Polar Surface Area: 73 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 64.1±3.0 dyne/cm
Molar Volume: 250.1±3.0 cm3

Click to predict properties on the Chemicalize site


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