ChemSpider 2D Image | N-(4-Chloro-1,3-benzothiazol-2-yl)-N-methylglycine | C10H9ClN2O2S

N-(4-Chloro-1,3-benzothiazol-2-yl)-N-methylglycine

  • Molecular FormulaC10H9ClN2O2S
  • Average mass256.709 Da
  • Monoisotopic mass256.007324 Da
  • ChemSpider ID26286579

More details:

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

Glycine, N-(4-chloro-2-benzothiazolyl)-N-methyl- [ACD/Index Name]
N-(4-Chlor-1,3-benzothiazol-2-yl)-N-methylglycin [German] [ACD/IUPAC Name]
N-(4-Chloro-1,3-benzothiazol-2-yl)-N-methylglycine [ACD/IUPAC Name]
N-(4-Chloro-1,3-benzothiazol-2-yl)-N-méthylglycine [French] [ACD/IUPAC Name]
[(4-chloro-1,3-benzothiazol-2-yl)(methyl)amino]acetic acid
1353000-10-8 [RN]
2-[(4-chloro-1,3-benzothiazol-2-yl)(methyl)amino]acetic acid
2-[(4-chloro-1,3-benzothiazol-2-yl)-methylamino]acetic acid
AKOS015957724
F2145-0755
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 427.3±51.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.9±3.0 kJ/mol
    Flash Point: 212.2±30.4 °C
    Index of Refraction: 1.718
    Molar Refractivity: 66.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.42
    ACD/LogD (pH 5.5): 0.79
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 10.20
    ACD/LogD (pH 7.4): -0.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 82 Å2
    Polarizability: 26.2±0.5 10-24cm3
    Surface Tension: 72.3±3.0 dyne/cm
    Molar Volume: 167.3±3.0 cm3

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