ChemSpider 2D Image | 2-Methyl-2-propanyl (1,1-dioxido-3-thietanyl)carbamate | C8H15NO4S

2-Methyl-2-propanyl (1,1-dioxido-3-thietanyl)carbamate

  • Molecular FormulaC8H15NO4S
  • Average mass221.274 Da
  • Monoisotopic mass221.072174 Da
  • ChemSpider ID57422774

More details:

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

(1,1-Dioxydo-3-thiétanyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1332628-90-6 [RN]
2-Methyl-2-propanyl (1,1-dioxido-3-thietanyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1,1-dioxido-3-thietanyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(1,1-dioxido-3-thietanyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
CS-16676
MFCD28656713
N-(1,1-DIOXIDO-3-THIETANYL)-CARBAMIC ACID 1,1-DIMETHYLETHYL ESTER
tert-Butyl (1,1-dioxidothietan-3-yl)carbamate

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

'0 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 413.4±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.6±3.0 kJ/mol
    Flash Point: 203.8±25.7 °C
    Index of Refraction: 1.501
    Molar Refractivity: 51.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.34
    ACD/LogD (pH 5.5): -0.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 19.03
    ACD/LogD (pH 7.4): -0.18
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 19.01
    Polar Surface Area: 81 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 43.7±5.0 dyne/cm
    Molar Volume: 174.4±5.0 cm3

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