Chemical Properties of 2-Furanmethanol, propanoate (CAS 623-19-8)

InChI

InChI=1S/C8H10O3/c1-2-8(9)11-6-7-4-3-5-10-7/h3-5H,2,6H2,1H3

InChI Key

LGBXNZSSTFWRFS-UHFFFAOYSA-N

Formula

C8H10O3

SMILES

CCC(=O)OCc1ccco1

Molecular Weight¹

154.16

CAS

623-19-8

Other Names

• Furfuryl alcohol, propionate
• Furfuryl propionate
• 2-furfuryl propanoate
• Furfuryl alcohol propanoate
• furfuryl-propanoate

• 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	-6.20		Crippen Calculated Property
logPoct/wat	1.733		Crippen Calculated Property
McVol	117.430	ml/mol	McGowan Calculated Property
Inp	[1059.00; 1096.00]
Inp	1096.00		NIST
Inp	1059.00		NIST
Inp	1059.00		NIST
I	[1578.00; 1626.00]
I	1603.00		NIST
I	1602.00		NIST
I	1602.00		NIST
I	1578.00		NIST
I	1578.00		NIST
I	1583.00		NIST
I	1583.00		NIST
I	1583.00		NIST
I	1584.00		NIST
I	1626.00		NIST
I	1620.00		NIST
I	1620.00		NIST
I	1599.00		NIST
I	1620.00		NIST
I	1606.00		NIST
I	1587.00		NIST
I	1626.00		NIST

Similar Compounds

Find more compounds similar to 2-Furanmethanol, propanoate.

Sources

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

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