Chemical Properties of Thiazole, 2-methyl-4-phenyl- (CAS 1826-16-0)

InChI

InChI=1S/C10H9NS/c1-8-11-10(7-12-8)9-5-3-2-4-6-9/h2-7H,1H3

InChI Key

XROORURTAQOYLW-UHFFFAOYSA-N

Formula

C10H9NS

SMILES

Cc1nc(-c2ccccc2)cs1

Molecular Weight¹

175.25

CAS

1826-16-0

Other Names

• 2-methyl-4-phenylthiazole

• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
logPoct/wat	3.119		Crippen Calculated Property
McVol	134.870	ml/mol	McGowan Calculated Property
I	[2279.00; 2279.00]
I	2279.00		NIST
I	2279.00		NIST
Tfus	286.88	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 Thiazole, 2-methyl-4-phenyl-.

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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