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Search term: PUXMAVZQHKAIDA (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2-[2-(Methylthio)propyl]-4-thiazolidinecarboxylic acid | C8H15NO2S2

2-[2-(Methylthio)propyl]-4-thiazolidinecarboxylic acid

  • Molecular FormulaC8H15NO2S2
  • Average mass221.340 Da
  • Monoisotopic mass221.054413 Da
  • ChemSpider ID21470401

More details:






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

1214690-99-9 [RN]
2-[2-(Methylsulfanyl)propyl]-1,3-thiazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
2-[2-(Methylsulfanyl)propyl]-1,3-thiazolidine-4-carboxylic acid [ACD/IUPAC Name]
2-[2-(Methylthio)propyl]-4-thiazolidinecarboxylic acid [ACD/IUPAC Name]
4-Thiazolidinecarboxylic acid, 2-[2-(methylthio)propyl]- [ACD/Index Name]
Acide 2-[2-(méthylsulfanyl)propyl]-1,3-thiazolidine-4-carboxylique [French] [ACD/IUPAC Name]
T5M CSTJ B1Y1&S1 EVQ [WLN]
2-(2-Methylsulfanylpropyl)-1,3-thiazolidine-4-carboxylic acid
2-[2-(Methylthio)propyl]thiazolidine-4-carboxylic acid [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 409.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 72.5±6.0 kJ/mol
Flash Point: 201.2±27.3 °C
Index of Refraction: 1.552
Molar Refractivity: 58.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 181.4±3.0 cm3

Click to predict properties on the Chemicalize site






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