Found 1898 results

Search term: MF = 'C_{12}H_{20}N_{2}O_{5}S'
ChemSpider 2D Image | 3-Methyl-1-[1-(methylsulfonyl)prolyl]-3-pyrrolidinecarboxylic acid | C12H20N2O5S

3-Methyl-1-[1-(methylsulfonyl)prolyl]-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC12H20N2O5S
  • Average mass304.363 Da
  • Monoisotopic mass304.109283 Da
  • ChemSpider ID40241356

More details:

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

3-Methyl-1-[1-(methylsulfonyl)prolyl]-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
3-Methyl-1-[1-(methylsulfonyl)prolyl]-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 3-methyl-1-[[1-(methylsulfonyl)-2-pyrrolidinyl]carbonyl]- [ACD/Index Name]
Acide 3-méthyl-1-[1-(méthylsulfonyl)prolyl]-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1-(1-METHANESULFONYLPYRROLIDINE-2-CARBONYL)-3-METHYLPYRROLIDINE-3-CARBOXYLIC ACID

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

Density: 1.4±0.1 g/cm3
Boiling Point: 535.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 88.8±6.0 kJ/mol
Flash Point: 277.8±32.9 °C
Index of Refraction: 1.585
Molar Refractivity: 71.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.51
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.90
ACD/LogD (pH 7.4): -2.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 214.5±5.0 cm3

Click to predict properties on the Chemicalize site


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