Chemical Properties of S-(2-Methylallyl)-N,N-dimethyldithiocarbamate

InChI

InChI=1S/C9H17NS2/c1-5-10(6-2)9(11)12-7-8(3)4/h3,5-7H2,1-2,4H3

InChI Key

NWZQNOBXSVYLDR-UHFFFAOYSA-N

Formula

C9H17NS2

SMILES

C=C(C)CSC(=S)N(CC)CC

Molecular Weight¹

203.37

• 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°	365.15	kJ/mol	Joback Calculated Property
ΔfH°gas	142.45	kJ/mol	Joback Calculated Property
ΔfusH°	28.23	kJ/mol	Joback Calculated Property
ΔvapH°	50.63	kJ/mol	Joback Calculated Property
log10WS	-3.24		Crippen Calculated Property
logPoct/wat	2.922		Crippen Calculated Property
McVol	171.750	ml/mol	McGowan Calculated Property
Pc	2690.21	kPa	Joback Calculated Property
Inp	[1500.00; 1500.00]
Inp	1500.00		NIST
Inp	1500.00		NIST
Tboil	553.14	K	Joback Calculated Property
Tc	766.25	K	Joback Calculated Property
Tfus	276.61	K	Joback Calculated Property
Vc	0.629	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[384.23; 458.16]	J/mol×K	[553.14; 766.25]
Cp,gas	384.23	J/mol×K	553.14	Joback Calculated Property
Cp,gas	398.65	J/mol×K	588.66	Joback Calculated Property
Cp,gas	412.15	J/mol×K	624.18	Joback Calculated Property
Cp,gas	424.79	J/mol×K	659.69	Joback Calculated Property
Cp,gas	436.63	J/mol×K	695.21	Joback Calculated Property
Cp,gas	447.73	J/mol×K	730.73	Joback Calculated Property
Cp,gas	458.16	J/mol×K	766.25	Joback Calculated Property

Similar Compounds

Find more compounds similar to S-(2-Methylallyl)-N,N-dimethyldithiocarbamate.

Sources

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

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