ChemSpider 2D Image | S-Ethyl acetamidoethanethioate | C6H11NO2S

S-Ethyl acetamidoethanethioate

  • Molecular FormulaC6H11NO2S
  • Average mass161.222 Da
  • Monoisotopic mass161.051056 Da
  • ChemSpider ID23351145

More details:

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

4396-62-7 [RN]
Acétamidoéthanethioate de S-éthyle [French] [ACD/IUPAC Name]
Ethanethioic acid, (acetylamino)-, S-ethyl ester [ACD/Index Name]
Ethanethioic acid, 2-(acetylamino)-, S-ethyl ester [ACD/Index Name]
S-Ethyl acetamidoethanethioate [ACD/IUPAC Name]
S-Ethyl-acetamidoethanthioat [German] [ACD/IUPAC Name]

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

B543EKV89X [DBID]
UNII:B543EKV89X [DBID]
UNII-B543EKV89X [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 322.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 148.7±23.2 °C
Index of Refraction: 1.486
Molar Refractivity: 41.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.03
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.03
Polar Surface Area: 71 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 144.6±3.0 cm3

Click to predict properties on the Chemicalize site


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