Chemical Properties of Furan, 3,3'-dithiobis[2-methyl- (CAS 28588-75-2)

InChI

InChI=1S/C10H10O2S2/c1-7-9(3-5-11-7)13-14-10-4-6-12-8(10)2/h3-6H,1-2H3

InChI Key

OHDFENKFSKIFBJ-UHFFFAOYSA-N

Formula

C10H10O2S2

SMILES

Cc1occc1SSc1ccoc1C

Molecular Weight¹

226.31

CAS

28588-75-2

Other Names

• bis(2-methyl-3-furyl)disulphide
• bis(2-methyl-3-furanyl) disulfide
• bis-[(2-Methylfuryl-3)] disulfide
• bis-(2-Methylfuryl-3-) disulfide
• Bis(2-methyl-3-furyI)-disulfide
• bis(2-methylfuryl) disulfide
• 3,3'-dithiobis[2-methylfuran]

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4186		Relay (1.0) Calculated Property
ΔfG°	31.32	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-84.32	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	79.08	kJ/mol	Relay (1.0) Calculated Property
IE	8.07	eV	Relay (1.0) Calculated Property
log10WS	-4.25		Relay (1.0) Calculated Property
logPoct/wat	4.289		Crippen Calculated Property
McVol	157.280	ml/mol	McGowan Calculated Property
Pc	3146.63	kPa	Relay (1.0-beta) Calculated Property
Inp	[1508.00; 1552.00]
Inp	1527.00		NIST
Inp	1552.00		NIST
Inp	1541.00		NIST
Inp	1535.00		NIST
Inp	1540.00		NIST
Inp	1510.00		NIST
Inp	1526.00		NIST
Inp	1547.00		NIST
Inp	1508.00		NIST
Inp	1526.00		NIST
Inp	1527.00		NIST
Inp	1510.00		NIST
I	[2100.00; 2140.00]
I	2124.00		NIST
I	2100.00		NIST
I	2110.00		NIST
I	2140.00		NIST
I	2100.00		NIST
I	2140.00		NIST
Tboil	582.82	K	Relay (1.0) Calculated Property
Tc	786.96	K	Relay (1.0) Calculated Property
Tfus	339.80	K	Relay (1.0) Calculated Property
Vc	0.589	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Furan, 3,3'-dithiobis[2-methyl-.

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

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