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Predicted properties of the compound entered.

ID JFUVVVIHTRWIBB-UHFFFAOYSA-N
Formula C20H29N3O4S2
IUPAC Name 4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C20H29N3O4S2/c1-3-22(4-2)29(26,27)16-9-10-18-17(13-16)23(20(25)15-28-18)14-19(24)21-11-7-5-6-8-12-21/h9-10,13H,3-8,11-12,14-15H2,1-2H3
Standard InChIKey (User Input) InChIKey=JFUVVVIHTRWIBB-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers 4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-diethyl-3-oxo-1,4-benzothiazine-6-sulfonamide | 4-[2-(azepan-1-yl)-2-oxo-ethyl]-N,N-diethyl-3-oxo-1,4-benzothiazine-6-sulfonamide | 4-[2-(1-azepanyl)-2-oxoethyl]-N,N-diethyl-3-oxo-1,4-benzothiazine-6-sulfonamide | 4-[2-(azepan-1-yl)-2-keto-ethyl]-N,N-diethyl-3-keto-1,4-benzothiazine-6-sulfonamide
Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -