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Search term: MF = 'C_{10}H_{21}NO_{2}S'
ChemSpider 2D Image | N-(5-methylhexan-2-yl)-1,1-dioxothietan-3-amine | C10H21NO2S

N-(5-methylhexan-2-yl)-1,1-dioxothietan-3-amine

  • Molecular FormulaC10H21NO2S
  • Average mass219.344 Da
  • Monoisotopic mass219.129303 Da
  • ChemSpider ID71046873

More details:

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

1,1-Dioxyde de N-(5-méthyl-2-hexanyl)-3-thiétanamine [French] [ACD/IUPAC Name]
1851900-80-5 [RN]
3-Thietanamine, N-(1,4-dimethylpentyl)-, 1,1-dioxide [ACD/Index Name]
N-(5-Methyl-2-hexanyl)-3-thietanamin-1,1-dioxid [German] [ACD/IUPAC Name]
N-(5-Methyl-2-hexanyl)-3-thietanamine 1,1-dioxide [ACD/IUPAC Name]
N-(5-methylhexan-2-yl)-1,1-dioxothietan-3-amine
3-((5-Methylhexan-2-yl)amino)thietane 1,1-dioxide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 360.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 171.6±25.9 °C
Index of Refraction: 1.485
Molar Refractivity: 58.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.83
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.02
ACD/KOC (pH 7.4): 75.29
Polar Surface Area: 55 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 36.4±5.0 dyne/cm
Molar Volume: 204.7±5.0 cm3

Click to predict properties on the Chemicalize site


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