Found 31 results

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

3-(3-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 ID65671776

More details:

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

1,3-Azetidinedicarboxylic acid, 3-(tetrahydro-3-hydroxy-1,1-dioxido-3-thienyl)-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
3-(3-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
3-(3-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-azetidinecarboxylic acid [ACD/IUPAC Name]
Acide 3-(3-hydroxy-1,1-dioxydotétrahydro-3-thiophényl)-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-azétidinecarboxylique [French] [ACD/IUPAC Name]
1-[(tert-butoxy)carbonyl]-3-(3-hydroxy-1,1-dioxo-1λ6-thiolan-3-yl)azetidine-3-carboxylic acid
2172035-09-3 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 574.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.8±6.0 kJ/mol
Flash Point: 301.0±30.1 °C
Index of Refraction: 1.592
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: -0.20
ACD/LogD (pH 5.5): -2.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.73
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: 71.1±3.0 dyne/cm
Molar Volume: 224.3±3.0 cm3

Click to predict properties on the Chemicalize site


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