Chemical Properties of 1,3,5-Dithiazine, perhydro-2,4-dimethyl-6-pentyl

InChI

InChI=1S/C10H21NS2/c1-4-5-6-7-10-11-8(2)12-9(3)13-10/h8-11H,4-7H2,1-3H3

InChI Key

CHNBDSZQZNEBGF-UHFFFAOYSA-N

Formula

C10H21NS2

SMILES

CCCCCC1NC(C)SC(C)S1

Molecular Weight¹

219.41

• 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°	209.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-107.76	kJ/mol	Joback Calculated Property
ΔfusH°	32.54	kJ/mol	Joback Calculated Property
ΔvapH°	56.05	kJ/mol	Joback Calculated Property
log10WS	-4.68		Crippen Calculated Property
logPoct/wat	3.654		Crippen Calculated Property
McVol	183.580	ml/mol	McGowan Calculated Property
Pc	2436.25	kPa	Joback Calculated Property
Inp	[1564.00; 1564.00]
Inp	1564.00		NIST
Inp	1564.00		NIST
Tboil	582.62	K	Joback Calculated Property
Tc	809.24	K	Joback Calculated Property
Tfus	473.29	K	Joback Calculated Property
Vc	0.655	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[456.06; 559.20]	J/mol×K	[582.62; 809.24]
Cp,gas	456.06	J/mol×K	582.62	Joback Calculated Property
Cp,gas	475.93	J/mol×K	620.39	Joback Calculated Property
Cp,gas	494.70	J/mol×K	658.16	Joback Calculated Property
Cp,gas	512.40	J/mol×K	695.93	Joback Calculated Property
Cp,gas	529.04	J/mol×K	733.70	Joback Calculated Property
Cp,gas	544.63	J/mol×K	771.47	Joback Calculated Property
Cp,gas	559.20	J/mol×K	809.24	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,3,5-Dithiazine, perhydro-2,4-dimethyl-6-pentyl.

Sources

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

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