Chemical Properties of 2-Aminobenzothiazole

InChI

InChI=1S/C7H6N2S/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H2,8,9)

InChI Key

UHGULLIUJBCTEF-UHFFFAOYSA-N

Formula

C7H6N2S

SMILES

Nc1nc2ccccc2s1

Molecular Weight¹

150.21

Other Names

• 2(3H)-Benzothiazolimine
• 2-Aminobenzthiazole
• 2-Benzothiazolylamine
• 2-Iminobenzothiazoline
• 2-aminobenzo[d]thiazole
• 2-benzothiazolamine
• Benzothiazol-2-ylamine
• Benzothiazole, 2-amino-
• NSC 4670
• USAF EK-3941
• USAF XR-27
• o-Aminobenzothiazole

• C_p,solid : Solid phase heat capacity (J/mol×K).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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.

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 2-Aminobenzothiazole.

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
• Standard enthalpies of formation of 2-aminobenzothiazoles in the crystalline phase by rotating-bomb combustion calorimetry
• Thermodynamic study of 2-aminothiazole and 2-aminobenzothiazole: Experimental and computational approaches
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.