Chemical Properties of 1-Methyldibenzofuran (CAS 7320-50-5)

InChI

InChI=1S/C13H10O/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)14-12/h2-8H,1H3

InChI Key

GGXKQILBNJUKSH-UHFFFAOYSA-N

Formula

C13H10O

SMILES

Cc1cccc2oc3ccccc3c12

Molecular Weight¹

182.22

CAS

7320-50-5

• 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	-9.29		Crippen Calculated Property
logPoct/wat	3.894		Crippen Calculated Property
McVol	141.520	ml/mol	McGowan Calculated Property
Inp	[274.89; 275.56]
Inp	274.89		NIST
Inp	275.56		NIST

Similar Compounds

Find more compounds similar to 1-Methyldibenzofuran.

Sources

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

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