Chemical Properties of 1,7-Dioxa-4,10-13-trithiacyclopentadecane

InChI

InChI=1S/C10H20O2S3/c1-5-13-6-2-12-4-8-15-10-9-14-7-3-11-1/h1-10H2

InChI Key

SOEJNDLYEVYFIB-UHFFFAOYSA-N

Formula

C10H20O2S3

SMILES

C1CSCCOCCSCCSCCO1

Molecular Weight¹

268.46

• 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).
• 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
ΔfG°	-96.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-358.73	kJ/mol	Joback Calculated Property
ΔfusH°	20.45	kJ/mol	Joback Calculated Property
ΔvapH°	66.60	kJ/mol	Joback Calculated Property
log10WS	-1.73		Crippen Calculated Property
logPoct/wat	2.233		Crippen Calculated Property
McVol	201.690	ml/mol	McGowan Calculated Property
Pc	3261.58	kPa	Joback Calculated Property
Inp	[2172.00; 2257.10]
Inp	2172.00		NIST
Inp	2172.00		NIST
Inp	2257.10		NIST
Inp	2172.00		NIST
Tboil	688.24	K	Joback Calculated Property
Tc	998.59	K	Joback Calculated Property
Tfus	485.89	K	Joback Calculated Property
Vc	0.637	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[537.20; 647.45]	J/mol×K	[688.24; 998.59]
Cp,gas	537.20	J/mol×K	688.24	Joback Calculated Property
Cp,gas	562.87	J/mol×K	739.96	Joback Calculated Property
Cp,gas	585.75	J/mol×K	791.69	Joback Calculated Property
Cp,gas	605.74	J/mol×K	843.41	Joback Calculated Property
Cp,gas	622.75	J/mol×K	895.14	Joback Calculated Property
Cp,gas	636.69	J/mol×K	946.86	Joback Calculated Property
Cp,gas	647.45	J/mol×K	998.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,7-Dioxa-4,10-13-trithiacyclopentadecane.

Sources

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

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