ChemSpider 2D Image | 1-(Cyclopropylsulfonyl)-3-azetidinecarboxylic acid | C7H11NO4S

1-(Cyclopropylsulfonyl)-3-azetidinecarboxylic acid

  • Molecular FormulaC7H11NO4S
  • Average mass205.232 Da
  • Monoisotopic mass205.040878 Da
  • ChemSpider ID25083680

More details:

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

1-(cyclopropanesulfonyl)azetidine-3-carboxylic acid
1-(Cyclopropylsulfonyl)-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
1-(Cyclopropylsulfonyl)-3-azetidinecarboxylic acid [ACD/IUPAC Name]
1219827-77-6 [RN]
3-Azetidinecarboxylic acid, 1-(cyclopropylsulfonyl)- [ACD/Index Name]
Acide 1-(cyclopropylsulfonyl)-3-azétidinecarboxylique [French] [ACD/IUPAC Name]
1-(cyclopropylsulfonyl)azetidine-3-carboxylic acid
1-cyclopropylsulfonylazetidine-3-carboxylic acid
AKOS013877286
F2158-1528
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 414.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.2±6.0 kJ/mol
    Flash Point: 204.6±31.5 °C
    Index of Refraction: 1.606
    Molar Refractivity: 44.7±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.59
    ACD/LogD (pH 5.5): -2.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.64
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 83 Å2
    Polarizability: 17.7±0.5 10-24cm3
    Surface Tension: 70.5±5.0 dyne/cm
    Molar Volume: 129.5±5.0 cm3

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