Chemical Properties of Bis(2-furfuryl)disulfide (CAS 4437-20-1)

InChI

InChI=1S/C10H10O2S2/c1-3-9(11-5-1)7-13-14-8-10-4-2-6-12-10/h1-6H,7-8H2

InChI Key

CBJPZHSWLMJQRI-UHFFFAOYSA-N

Formula

C10H10O2S2

SMILES

c1coc(CSSCc2ccco2)c1

Molecular Weight¹

226.31

CAS

4437-20-1

Other Names

• Furan, 2,2'-[dithiobis(methylene)]bis-
• 2,2'-[Dithiobis(methylene)]bisfuran
• Furfuryl disulfide
• bis(2-Furanylmethyl) disulfide
• Bis-2-Furfuryl disulphide
• bis(2-Furylmethyl)disulfide
• bis(2-Furylmethyl) disulphide
• bis-Furfuryl disulfide
• bis-(Furylmethyl) disulfide
• di-2-Furfuryl disulfide
• 2-difurfuryl disulfide

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-13.25	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	85.73	kJ/mol	Relay (1.0) Calculated Property
IE	8.58	eV	Relay (1.0) Calculated Property
logPoct/wat	3.954		Crippen Calculated Property
McVol	157.280	ml/mol	McGowan Calculated Property
Inp	[1655.00; 1710.00]
Inp	1683.00		NIST
Inp	1701.00		NIST
Inp	1702.00		NIST
Inp	1658.00		NIST
Inp	1658.00		NIST
Inp	1710.00		NIST
Inp	1673.00		NIST
Inp	1673.00		NIST
Inp	1673.00		NIST
Inp	1701.00		NIST
Inp	1655.00		NIST
Inp	1660.00		NIST
Inp	1710.00		NIST
Inp	1683.00		NIST
Inp	1710.00		NIST
Inp	1660.00		NIST
I	[2465.00; 2520.00]
I	2520.00		NIST
I	2465.00		NIST
I	2465.00		NIST
I	2465.00		NIST
I	2520.00		NIST
Tboil	585.15	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Bis(2-furfuryl)disulfide.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.