Chemical Properties of 2-methyl-3-furyl 2-oxo-3-pentyl disulfide

InChI

InChI=1S/C10H14O2S2/c1-4-9(7(2)11)13-14-10-5-6-12-8(10)3/h5-6,9H,4H2,1-3H3

InChI Key

HUNHUMWMMZADPP-UHFFFAOYSA-N

Formula

C10H14O2S2

SMILES

CCC(SSc1ccoc1C)C(C)=O

Molecular Weight¹

230.35

Other Names

• 2-Pentanone, 3-(2-methyl-3-furyldithio)

• 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	-8.37		Crippen Calculated Property
logPoct/wat	3.696		Crippen Calculated Property
McVol	172.440	ml/mol	McGowan Calculated Property
Inp	[1557.00; 1580.00]
Inp	1571.00		NIST
Inp	1574.00		NIST
Inp	1574.00		NIST
Inp	1580.00		NIST
Inp	1561.00		NIST
Inp	1561.00		NIST
Inp	1580.00		NIST
Inp	1557.00		NIST
Inp	1561.00		NIST
Inp	1557.00		NIST
Inp	1571.00		NIST
I	[2145.00; 2205.00]
I	2205.00		NIST
I	2145.00		NIST
I	2145.00		NIST
I	2205.00		NIST
I	2145.00		NIST

Similar Compounds

Find more compounds similar to 2-methyl-3-furyl 2-oxo-3-pentyl disulfide.

Sources

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

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