Chemical Properties of Dibenzothiophene, 4,6-dimethyl- (CAS 1207-12-1)

InChI

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

InChI Key

MYAQZIAVOLKEGW-UHFFFAOYSA-N

Formula

C14H12S

SMILES

Cc1cccc2c1sc1c(C)cccc12

Molecular Weight¹

212.31

CAS

1207-12-1

Other Names

• 4,6-dimethyldibenzo[b,d]thiophene
• 4,6-dimethyldibenzothiophene

• 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	-5.79		Crippen Calculated Property
logPoct/wat	4.671		Crippen Calculated Property
McVol	166.090	ml/mol	McGowan Calculated Property
Inp	[325.75; 2033.00]
Inp	Outlier 2033.00		NIST
Inp	Outlier 2029.00		NIST
Inp	Outlier 2029.00		NIST
Inp	328.80		NIST
Inp	327.55		NIST
Inp	328.32		NIST
Inp	329.46		NIST
Inp	329.68		NIST
Inp	329.20		NIST
Inp	333.60		NIST
Inp	329.17		NIST
Inp	327.77		NIST
Inp	325.75		NIST
Inp	329.17		NIST
Inp	329.60		NIST
Inp	329.20		NIST
Inp	329.20		NIST

Similar Compounds

Find more compounds similar to Dibenzothiophene, 4,6-dimethyl-.

Mixtures

• Dodecane + Dibenzothiophene, 4,6-dimethyl-

Sources

• Crippen Method
• Crippen Method
• Liquid-Liquid Equilibria for {1-Ethyl-3-methylimidazolium Diethylphosphate or 1-Ethyl-3-methylimidazolium Ethylsulfate} + 4,6-Dimethyldibenzothiophene + Dodecane Systems at 298.2 K and 313.2 K
• Apparent and Partial Molar Volumes at Infinite Dilution and Solid Liquid Equilibria of Dibenzothiophene + Alkane Systems
• 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.