Chemical Properties of Furfuryl pentanoate (CAS 36701-01-6)

InChI

InChI=1S/C10H14O3/c1-2-3-6-10(11)13-8-9-5-4-7-12-9/h4-5,7H,2-3,6,8H2,1H3

InChI Key

HRYAVTBTUKVHBU-UHFFFAOYSA-N

Formula

C10H14O3

SMILES

CCCCC(=O)OCc1ccco1

Molecular Weight¹

182.22

CAS

36701-01-6

Other Names

• Pentanoic acid, 2-furanylmethyl ester
• Furfuryl valerate

• 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	-7.04		Crippen Calculated Property
logPoct/wat	2.513		Crippen Calculated Property
McVol	145.610	ml/mol	McGowan Calculated Property
Inp	[1245.00; 1245.00]
Inp	1245.00		NIST
Inp	1245.00		NIST
I	1753.00		NIST

Similar Compounds

Find more compounds similar to Furfuryl pentanoate.

Sources

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

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