Chemical Properties of 2,6-dimethyl-4-ethyl-3,5-dithiaheptane

InChI

InChI=1S/C9H20S2/c1-6-9(10-7(2)3)11-8(4)5/h7-9H,6H2,1-5H3

InChI Key

IEVDPNZUQCRZHC-UHFFFAOYSA-N

Formula

C9H20S2

SMILES

CCC(SC(C)C)SC(C)C

Molecular Weight¹

192.38

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion 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.
• 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	0.3534		Relay (... Calculated Property
ΔfG°	83.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-182.29	kJ/mol	Relay (... Calculated Property
ΔfusH°	16.76	kJ/mol	Joback Calculated Property
ΔvapH°	57.05	kJ/mol	Relay (... Calculated Property
IE	8.12	eV	Relay (... Calculated Property
log10WS	-3.71		Relay (... Calculated Property
logPoct/wat	4.006		Crippen Calculated Property
McVol	170.370	ml/mol	McGowan Calculated Property
Pc	2441.06	kPa	Joback Calculated Property
Inp	[1218.00; 1218.00]
Inp	1218.00		NIST
Inp	1218.00		NIST
Tboil	486.45	K	Relay (... Calculated Property
Tc	666.15	K	Relay (... Calculated Property
Tfus	210.65	K	Relay (... Calculated Property
Vc	0.589	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[387.89; 474.98]	J/mol×K	[541.56; 758.12]
Cp,gas	387.89	J/mol×K	541.56	Joback Calculated Property
Cp,gas	404.50	J/mol×K	577.65	Joback Calculated Property
Cp,gas	420.26	J/mol×K	613.75	Joback Calculated Property
Cp,gas	435.17	J/mol×K	649.84	Joback Calculated Property
Cp,gas	449.26	J/mol×K	685.94	Joback Calculated Property
Cp,gas	462.52	J/mol×K	722.03	Joback Calculated Property
Cp,gas	474.98	J/mol×K	758.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6-dimethyl-4-ethyl-3,5-dithiaheptane.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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