Found 3024 results

Search term: MF = 'C_{15}H_{13}NOS'
ChemSpider 2D Image | 3-(4-Methoxyphenyl)-2H-1,4-benzothiazine | C15H13NOS

3-(4-Methoxyphenyl)-2H-1,4-benzothiazine

  • Molecular FormulaC15H13NOS
  • Average mass255.335 Da
  • Monoisotopic mass255.071777 Da
  • ChemSpider ID21470284

More details:

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

2H-1,4-Benzothiazine, 3-(4-methoxyphenyl)- [ACD/Index Name]
3-(4-Methoxyphenyl)-2H-1,4-benzothiazin [German] [ACD/IUPAC Name]
3-(4-Methoxyphenyl)-2H-1,4-benzothiazine [ACD/IUPAC Name]
3-(4-Méthoxyphényl)-2H-1,4-benzothiazine [French] [ACD/IUPAC Name]
3-(4-Methoxy-phenyl)-2H-benzo[1,4]thiazine
76148-93-1 [RN]
2H-1,4-Benzothiazine,3-(4-methoxyphenyl)-
3-(4-methoxyphenyl)-2H-benzo[b][1,4]thiazine
atoms 18 bonds 20
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL445769/
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 389.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 61.4±3.0 kJ/mol
    Flash Point: 189.4±27.9 °C
    Index of Refraction: 1.632
    Molar Refractivity: 76.1±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.65
    ACD/LogD (pH 5.5): 3.68
    ACD/BCF (pH 5.5): 369.77
    ACD/KOC (pH 5.5): 2380.31
    ACD/LogD (pH 7.4): 3.70
    ACD/BCF (pH 7.4): 379.05
    ACD/KOC (pH 7.4): 2440.06
    Polar Surface Area: 47 Å2
    Polarizability: 30.2±0.5 10-24cm3
    Surface Tension: 44.1±7.0 dyne/cm
    Molar Volume: 213.4±7.0 cm3

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