Found 498 results

Search term: MF = 'C_{15}H_{13}NO_{5}S'
ChemSpider 2D Image | 4-(Phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid | C15H13NO5S

4-(Phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

  • Molecular FormulaC15H13NO5S
  • Average mass319.332 Da
  • Monoisotopic mass319.051453 Da
  • ChemSpider ID35227370

More details:

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

1858251-66-7 [RN]
2H-1,4-Benzoxazine-2-carboxylic acid, 3,4-dihydro-4-(phenylsulfonyl)- [ACD/Index Name]
4-(Phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-carbonsäure [German] [ACD/IUPAC Name]
4-(Phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-(phénylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylique [French] [ACD/IUPAC Name]
2H-1,4-benzoxazine-2-carboxylic acid, 3,4-dihydro-4-(phenylsulfonyl)
4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid
MFCD28954564

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 544.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.6±3.0 kJ/mol
    Flash Point: 283.0±32.9 °C
    Index of Refraction: 1.649
    Molar Refractivity: 79.4±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.20
    ACD/LogD (pH 5.5): -1.02
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 92 Å2
    Polarizability: 31.5±0.5 10-24cm3
    Surface Tension: 62.6±3.0 dyne/cm
    Molar Volume: 217.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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