Chemical Properties of 2-Furancarboxaldehyde, 5-[(5-methyl-2-furanyl)methyl]- (CAS 34995-74-9)

InChI

InChI=1S/C11H10O3/c1-8-2-3-9(13-8)6-10-4-5-11(7-12)14-10/h2-5,7H,6H2,1H3

InChI Key

KWIASFUDUPQEGZ-UHFFFAOYSA-N

Formula

C11H10O3

SMILES

Cc1ccc(Cc2ccc(C=O)o2)o1

Molecular Weight¹

190.20

CAS

34995-74-9

Other Names

• 2-(5-Methyl-2-furfuryl)-5-furfural

• 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.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-11.76		Crippen Calculated Property
logPoct/wat	2.584		Crippen Calculated Property
McVol	140.240	ml/mol	McGowan Calculated Property
Inp	1541.00		NIST
I	[2322.00; 2374.00]
I	2322.00		NIST
I	2374.00		NIST
I	2362.00		NIST
I	2363.00		NIST
I	2363.00		NIST
I	2362.00		NIST
I	2322.00		NIST

Similar Compounds

Find more compounds similar to 2-Furancarboxaldehyde, 5-[(5-methyl-2-furanyl)methyl]-.

Sources

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

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