ChemSpider 2D Image | (2Z)-N-Hydroxy-3,3-bis(methylsulfanyl)-2-butanimine | C6H13NOS2

(2Z)-N-Hydroxy-3,3-bis(methylsulfanyl)-2-butanimine

  • Molecular FormulaC6H13NOS2
  • Average mass179.303 Da
  • Monoisotopic mass179.043854 Da
  • ChemSpider ID34996990

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-N-Hydroxy-3,3-bis(methylsulfanyl)-2-butanimin [German] [ACD/IUPAC Name]
(2Z)-N-Hydroxy-3,3-bis(methylsulfanyl)-2-butanimine [ACD/IUPAC Name]
(2Z)-N-Hydroxy-3,3-bis(méthylsulfanyl)-2-butanimine [French] [ACD/IUPAC Name]
2-Butanone, 3,3-bis(methylthio)-, oxime, (2Z)- [ACD/Index Name]
3,3-bis(methylthio)butan-2-one oxime
3,3-bis-(Methylthio)butan-2-one oxime
94291-65-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 267.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 55.7±6.0 kJ/mol
Flash Point: 115.6±24.6 °C
Index of Refraction: 1.524
Molar Refractivity: 49.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.45
ACD/KOC (pH 5.5): 420.07
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.44
ACD/KOC (pH 7.4): 420.01
Polar Surface Area: 83 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 35.6±7.0 dyne/cm
Molar Volume: 161.9±7.0 cm3

Click to predict properties on the Chemicalize site


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