Chemical Properties of Furfuryl formate (CAS 13493-97-5)

InChI

InChI=1S/C6H6O3/c7-5-8-4-6-2-1-3-9-6/h1-3,5H,4H2

InChI Key

FPRQARNPKWVCNI-UHFFFAOYSA-N

Formula

C6H6O3

SMILES

O=COCc1ccco1

Molecular Weight¹

126.11

CAS

13493-97-5

Other Names

• 2-Furylmethyl formate
• Furfuryl methanoate
• 2-Furanmethanol, 2-formate
• furan-2-ylmethyl formate

• 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	-5.37		Crippen Calculated Property
logPoct/wat	0.953		Crippen Calculated Property
McVol	89.250	ml/mol	McGowan Calculated Property
Inp	[875.00; 902.00]
Inp	875.00		NIST
Inp	902.00		NIST
I	[1472.00; 1524.00]
I	1497.00		NIST
I	1472.00		NIST
I	1515.00		NIST
I	1478.00		NIST
I	1478.00		NIST
I	1479.00		NIST
I	1479.00		NIST
I	1480.00		NIST
I	1524.00		NIST
I	1519.00		NIST
I	1519.00		NIST
I	1519.00		NIST
I	1497.00		NIST
I	1504.00		NIST
I	1519.00		NIST
I	1515.00		NIST
I	1480.00		NIST
I	1472.00		NIST
I	1504.00		NIST

Similar Compounds

Find more compounds similar to Furfuryl formate.

Sources

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

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