ChemSpider 2D Image | 1-Bromo-4-(cyclopropylsulfonyl)benzene | C9H9BrO2S

1-Bromo-4-(cyclopropylsulfonyl)benzene

  • Molecular FormulaC9H9BrO2S
  • Average mass261.136 Da
  • Monoisotopic mass259.950653 Da
  • ChemSpider ID26699738

More details:

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

1-Brom-4-(cyclopropylsulfonyl)benzol [German] [ACD/IUPAC Name]
1-Bromo-4-(cyclopropylsulfonyl)benzene [ACD/IUPAC Name]
1-Bromo-4-(cyclopropylsulfonyl)benzène [French] [ACD/IUPAC Name]
648906-28-9 [RN]
Benzene, 1-bromo-4-(cyclopropylsulfonyl)- [ACD/Index Name]
[648906-28-9] [RN]
1-BROMO-4-(CYCLOPROPANESULFONYL)BENZENE
1-bromo-4-cyclopropylsulfonylbenzene
98%
MFCD20441880 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 391.0±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 61.6±3.0 kJ/mol
    Flash Point: 190.3±25.7 °C
    Index of Refraction: 1.621
    Molar Refractivity: 55.1±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.61
    ACD/LogD (pH 5.5): 1.86
    ACD/BCF (pH 5.5): 15.32
    ACD/KOC (pH 5.5): 245.50
    ACD/LogD (pH 7.4): 1.86
    ACD/BCF (pH 7.4): 15.32
    ACD/KOC (pH 7.4): 245.50
    Polar Surface Area: 43 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 53.1±3.0 dyne/cm
    Molar Volume: 156.7±3.0 cm3

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