ChemSpider 2D Image | [3-(Methylsulfonyl)-1-pyrrolidinyl](4-methyl-1,2,3-thiadiazol-5-yl)methanone | C9H13N3O3S2

[3-(Methylsulfonyl)-1-pyrrolidinyl](4-methyl-1,2,3-thiadiazol-5-yl)methanone

  • Molecular FormulaC9H13N3O3S2
  • Average mass275.348 Da
  • Monoisotopic mass275.039825 Da
  • ChemSpider ID30758828

More details:

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

[3-(Methylsulfonyl)-1-pyrrolidinyl](4-methyl-1,2,3-thiadiazol-5-yl)methanon [German] [ACD/IUPAC Name]
[3-(Methylsulfonyl)-1-pyrrolidinyl](4-methyl-1,2,3-thiadiazol-5-yl)methanone [ACD/IUPAC Name]
[3-(Méthylsulfonyl)-1-pyrrolidinyl](4-méthyl-1,2,3-thiadiazol-5-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-(methylsulfonyl)-1-pyrrolidinyl](4-methyl-1,2,3-thiadiazol-5-yl)- [ACD/Index Name]
(4-methyl-1,2,3-thiadiazol-5-yl)(3-(methylsulfonyl)pyrrolidin-1-yl)methanone
1448073-51-5 [RN]
5-(3-methanesulfonylpyrrolidine-1-carbonyl)-4-methyl-1,2,3-thiadiazole

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

Density: 1.5±0.1 g/cm3
Boiling Point: 548.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 285.3±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 63.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.01
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.48
ACD/LogD (pH 7.4): -0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.48
Polar Surface Area: 117 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 70.6±5.0 dyne/cm
Molar Volume: 185.6±5.0 cm3

Click to predict properties on the Chemicalize site


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