ChemSpider 2D Image | 2-(Chloromethyl)-5-methoxy-1,3-benzoxazole | C9H8ClNO2

2-(Chloromethyl)-5-methoxy-1,3-benzoxazole

  • Molecular FormulaC9H8ClNO2
  • Average mass197.618 Da
  • Monoisotopic mass197.024353 Da
  • ChemSpider ID21473001

More details:

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

2-(Chlormethyl)-5-methoxy-1,3-benzoxazol [German] [ACD/IUPAC Name]
2-(Chloromethyl)-5-methoxy-1,3-benzoxazole [ACD/IUPAC Name]
2-(Chlorométhyl)-5-méthoxy-1,3-benzoxazole [French] [ACD/IUPAC Name]
63842-21-7 [RN]
Benzoxazole, 2-(chloromethyl)-5-methoxy- [ACD/Index Name]
[63842-21-7] [RN]
2-(Chloromethyl)-5-methoxybenzo[d]oxazole
2-(chloromethyl)-5-methoxybenzoxazole
MFCD09836173 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 284.8±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.3±3.0 kJ/mol
    Flash Point: 126.0±21.8 °C
    Index of Refraction: 1.588
    Molar Refractivity: 50.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.97
    ACD/LogD (pH 5.5): 2.37
    ACD/BCF (pH 5.5): 36.98
    ACD/KOC (pH 5.5): 460.40
    ACD/LogD (pH 7.4): 2.37
    ACD/BCF (pH 7.4): 37.22
    ACD/KOC (pH 7.4): 463.45
    Polar Surface Area: 35 Å2
    Polarizability: 20.2±0.5 10-24cm3
    Surface Tension: 44.7±3.0 dyne/cm
    Molar Volume: 151.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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