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Search term: MF = 'C_{8}H_{15}NO_{2}S'
ChemSpider 2D Image | Methyl amino(tetrahydro-2H-thiopyran-4-yl)acetate | C8H15NO2S

Methyl amino(tetrahydro-2H-thiopyran-4-yl)acetate

  • Molecular FormulaC8H15NO2S
  • Average mass189.275 Da
  • Monoisotopic mass189.082352 Da
  • ChemSpider ID21540753

More details:

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

2H-Thiopyran-4-acetic acid, α-aminotetrahydro-, methyl ester [ACD/Index Name]
Amino(tétrahydro-2H-thiopyrane-4-yl)acétate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-amino-2-(tetrahydro-2H-thiopyran-4-yl)acetate
Methyl amino(tetrahydro-2H-thiopyran-4-yl)acetate [ACD/IUPAC Name]
Methyl-amino(tetrahydro-2H-thiopyran-4-yl)acetat [German] [ACD/IUPAC Name]
MFCD04115502 [MDL number]
[1134603-63-6] [RN]
1134603-63-6 [RN]
5-(2-thienyl)isoxazole-3-carboxylic acid
763109-71-3 [RN]
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 277.4±10.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.6±3.0 kJ/mol
    Flash Point: 121.5±19.0 °C
    Index of Refraction: 1.522
    Molar Refractivity: 50.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.67
    ACD/LogD (pH 5.5): -1.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.32
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 28.47
    Polar Surface Area: 78 Å2
    Polarizability: 20.0±0.5 10-24cm3
    Surface Tension: 43.6±3.0 dyne/cm
    Molar Volume: 165.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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