Chemical Properties of 9H-Thioxanthen-9-one, 2-(1-methylethyl)- (CAS 5495-84-1)

InChI

InChI=1S/C16H14OS/c1-10(2)11-7-8-15-13(9-11)16(17)12-5-3-4-6-14(12)18-15/h3-10H,1-2H3

InChI Key

KTALPKYXQZGAEG-UHFFFAOYSA-N

Formula

C16H14OS

SMILES

CC(C)c1ccc2sc3ccccc3c(=O)c2c1

Molecular Weight¹

254.35

CAS

5495-84-1

Other Names

• 2-(1-methylethyl)-9H-thioxanthen-9-one
• 2-isopropyl-9H-thioxanthen-9-one
• 2-isopropylthioxanthone
• 9H-Thioxanthen-9-one, 2-isopropyl
• Quantacure ITX
• Quantacure ITX (Isopropylthioxanthene-9-one)

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Similar Compounds

Find more compounds similar to 9H-Thioxanthen-9-one, 2-(1-methylethyl)-.

Mixtures

• Methyl Alcohol + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• Ethanol + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• Acetone + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• Toluene + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• Ethyl Acetate + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• 1,4-Dioxane + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-
• Ethane, 1,2-dichloro- + 9H-Thioxanthen-9-one, 2-(1-methylethyl)-

Sources

• Crippen Method
• Crippen Method
• Determination and Correlation of Solubilities of 2-Isopropylthioxanthone (ITX) in Seven Different Solvents from (299.15 to 329.85) K
• 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.