Found 31 results

Search term: MF = 'C_{13}H_{21}NO_{7}S'
ChemSpider 2D Image | 3-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid | C13H21NO7S

3-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid

  • Molecular FormulaC13H21NO7S
  • Average mass335.373 Da
  • Monoisotopic mass335.103882 Da
  • ChemSpider ID97221579

More details:

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

1,3-Azetidinedicarboxylic acid, 3-(tetrahydro-4-hydroxy-1,1-dioxido-3-thienyl)-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
3-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
3-(4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid [ACD/IUPAC Name]
Acide 3-(4-hydroxy-1,1-dioxydotétrahydro-3-thiophényl)-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-azétidinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 580.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.7±6.0 kJ/mol
Flash Point: 304.7±30.1 °C
Index of Refraction: 1.587
Molar Refractivity: 75.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.69
ACD/LogD (pH 5.5): -2.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 225.8±3.0 cm3

Click to predict properties on the Chemicalize site


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