Chemical Properties of Butyl methylaminodithiocarbamate

InChI

InChI=1S/C6H13NS2/c1-3-4-5-9-6(8)7-2/h3-5H2,1-2H3,(H,7,8)

InChI Key

XSVAFMVYJMBMRO-UHFFFAOYSA-N

Formula

C6H13NS2

SMILES

CCCCSC(=S)NC

Molecular Weight¹

163.30

• 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°	239.21	kJ/mol	Joback Calculated Property
ΔfH°gas	74.67	kJ/mol	Joback Calculated Property
ΔfusH°	25.13	kJ/mol	Joback Calculated Property
ΔvapH°	48.93	kJ/mol	Joback Calculated Property
log10WS	-2.75		Crippen Calculated Property
logPoct/wat	2.024		Crippen Calculated Property
McVol	133.780	ml/mol	McGowan Calculated Property
Pc	3577.07	kPa	Joback Calculated Property
Inp	[1595.00; 1618.00]
Inp	1600.00		NIST
Inp	1609.00		NIST
Inp	Outlier 1618.00		NIST
Inp	1595.00		NIST
Inp	1600.00		NIST
Inp	1605.00		NIST
Inp	1600.00		NIST
Inp	1605.00		NIST
Tboil	525.67	K	Joback Calculated Property
Tc	744.38	K	Joback Calculated Property
Tfus	278.71	K	Joback Calculated Property
Vc	0.496	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[280.82; 340.11]	J/mol×K	[525.67; 744.38]
Cp,gas	280.82	J/mol×K	525.67	Joback Calculated Property
Cp,gas	292.35	J/mol×K	562.12	Joback Calculated Property
Cp,gas	303.17	J/mol×K	598.57	Joback Calculated Property
Cp,gas	313.31	J/mol×K	635.03	Joback Calculated Property
Cp,gas	322.81	J/mol×K	671.48	Joback Calculated Property
Cp,gas	331.74	J/mol×K	707.93	Joback Calculated Property
Cp,gas	340.11	J/mol×K	744.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to Butyl methylaminodithiocarbamate.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.