Chemical Properties of 2-Thenylamine, n-methyl-n-2-propynyl- (CAS 2322-00-1)

InChI

InChI=1S/C9H11NS/c1-3-6-10(2)8-9-5-4-7-11-9/h1,4-5,7H,6,8H2,2H3

InChI Key

RROPBJSQMNTFLS-UHFFFAOYSA-N

Formula

C9H11NS

SMILES

C#CCN(C)Cc1cccs1

Molecular Weight¹

165.25

CAS

2322-00-1

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to 2-Thenylamine, n-methyl-n-2-propynyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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