Chemical Properties of Propyl methylaminodithiocarbamate

InChI

InChI=1S/C5H11NS2/c1-3-4-8-5(7)6-2/h3-4H2,1-2H3,(H,6,7)

InChI Key

KUDJTSQPXXVPAQ-UHFFFAOYSA-N

Formula

C5H11NS2

SMILES

CCCSC(=S)NC

Molecular Weight¹

149.28

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	22.54	kJ/mol	Joback Calculated Property
ΔvapH°	76.61	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	1.634		Crippen Calculated Property
McVol	119.690	ml/mol	McGowan Calculated Property
Inp	[1507.00; 1521.00]
Inp	1507.00		NIST
Inp	1509.00		NIST
Inp	1512.00		NIST
Inp	1516.00		NIST
Inp	1518.00		NIST
Inp	1521.00		NIST
Inp	1507.00		NIST
Inp	1521.00		NIST
Tboil	485.30	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[238.58; 291.87]	J/mol×K	[502.79; 725.26]
Cp,gas	238.58	J/mol×K	502.79	Joback Calculated Property
Cp,gas	249.00	J/mol×K	539.87	Joback Calculated Property
Cp,gas	258.76	J/mol×K	576.95	Joback Calculated Property
Cp,gas	267.88	J/mol×K	614.03	Joback Calculated Property
Cp,gas	276.41	J/mol×K	651.10	Joback Calculated Property
Cp,gas	284.39	J/mol×K	688.18	Joback Calculated Property
Cp,gas	291.87	J/mol×K	725.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propyl methylaminodithiocarbamate.

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
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.