ChemSpider 2D Image | 2,2-Dimethyl-3-thietanamine | C5H11NS

2,2-Dimethyl-3-thietanamine

  • Molecular FormulaC5H11NS
  • Average mass117.213 Da
  • Monoisotopic mass117.061218 Da
  • ChemSpider ID32974582

More details:

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

2,2-Dimethyl-3-thietanamin [German] [ACD/IUPAC Name]
2,2-Dimethyl-3-thietanamine [ACD/IUPAC Name]
2,2-Diméthyl-3-thiétanamine [French] [ACD/IUPAC Name]
2,2-dimethylthietan-3-amine
3-Thietanamine, 2,2-dimethyl- [ACD/Index Name]
943438-08-2 [RN]
(R)-2,2-Dimethylthietan-3-amine
MFCD19215819
MFCD29906877

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

Density: 1.0±0.1 g/cm3
Boiling Point: 158.9±33.0 °C at 760 mmHg
Vapour Pressure: 2.6±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.5±3.0 kJ/mol
Flash Point: 49.9±25.4 °C
Index of Refraction: 1.511
Molar Refractivity: 34.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.51
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 36.73
Polar Surface Area: 51 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 116.4±3.0 cm3

Click to predict properties on the Chemicalize site


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