Chemical Properties of Dibenzothiophene, 2-ethyl

InChI

InChI=1S/C14H12S/c1-2-10-7-8-14-12(9-10)11-5-3-4-6-13(11)15-14/h3-9H,2H2,1H3

InChI Key

OIWTUZCEIKRYCP-UHFFFAOYSA-N

Formula

C14H12S

SMILES

CCc1ccc2sc3ccccc3c2c1

Molecular Weight¹

212.31

Other Names

• 2-Ethyldibenzothiophene

• 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

Property	Value	Unit	Source
log10WS	-5.64		Crippen Calculated Property
logPoct/wat	4.617		Crippen Calculated Property
McVol	166.090	ml/mol	McGowan Calculated Property
Inp	[328.54; 332.80]
Inp	332.30		NIST
Inp	332.80		NIST
Inp	332.65		NIST
Inp	Outlier 328.54		NIST
Inp	332.40		NIST
Inp	332.50		NIST

Similar Compounds

Find more compounds similar to Dibenzothiophene, 2-ethyl.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.