Chemical Properties of N-Methylrhodanine (CAS 4807-55-0)

InChI

InChI=1S/C4H5NOS2/c1-5-3(6)2-8-4(5)7/h2H2,1H3

InChI Key

JKLZCQWVERBDEZ-UHFFFAOYSA-N

Formula

C4H5NOS2

SMILES

CN1C(=O)CSC1=S

Molecular Weight¹

147.22

CAS

4807-55-0

Other Names

• 4-Thiazolidinone, 3-methyl-2-thioxo-
• Methylrhodanine
• Rhodanine, N-methyl-
• Rhodanine, 3-methyl-
• USAF T-2
• 3-Methylrhodanine
• NSC 14787
• NSC 42903
• NSC 65351
• 3-Methylrhodanide

• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Ionization energy, Log10 of Water solubility in mol/l 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 N-Methylrhodanine.

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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