ChemSpider 2D Image | 2-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-2-methyl-1-propanol | C8H17NO3S

2-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-2-methyl-1-propanol

  • Molecular FormulaC8H17NO3S
  • Average mass207.290 Da
  • Monoisotopic mass207.092911 Da
  • ChemSpider ID15381834

More details:

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

1-Propanol, 2-methyl-2-[(tetrahydro-1,1-dioxido-3-thienyl)amino]- [ACD/Index Name]
2-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-2-methyl-1-propanol [ACD/IUPAC Name]
2-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-2-methyl-1-propanol [German] [ACD/IUPAC Name]
2-[(1,1-Dioxydotétrahydro-3-thiophényl)amino]-2-méthyl-1-propanol [French] [ACD/IUPAC Name]
2-((1,1-dioxidotetrahydrothien-3-yl)amino)-2-methylpropan-1-ol
3-[(1-hydroxy-2-methylpropan-2-yl)amino]-1λ6-thiolane-1,1-dione
3-[(1-hydroxy-2-methylpropan-2-yl)amino]-1λ6-thiolane-1,1-dione
3-[(1-hydroxy-2-methylpropan-2-yl)amino]-1λ6-thiolane-1,1-dione
56878-92-3 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4532257/
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 435.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.9±6.0 kJ/mol
Flash Point: 217.4±25.9 °C
Index of Refraction: 1.517
Molar Refractivity: 51.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.38
ACD/LogD (pH 5.5): -2.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.36
Polar Surface Area: 75 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 46.4±5.0 dyne/cm
Molar Volume: 168.6±5.0 cm3

Click to predict properties on the Chemicalize site


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