Chemical Properties of 2-Pyrazoline, 5-ethyl-5-methyl

InChI

InChI=1S/C6H12N2/c1-3-6(2)4-5-7-8-6/h5,8H,3-4H2,1-2H3

InChI Key

PYMHAFLRPRPQQA-UHFFFAOYSA-N

Formula

C6H12N2

SMILES

CCC1(C)CC=NN1

Molecular Weight¹

112.17

• 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°	265.15	kJ/mol	Joback Calculated Property
ΔfH°gas	75.11	kJ/mol	Joback Calculated Property
ΔfusH°	14.88	kJ/mol	Joback Calculated Property
ΔvapH°	41.32	kJ/mol	Joback Calculated Property
log10WS	-1.68		Crippen Calculated Property
logPoct/wat	1.134		Crippen Calculated Property
McVol	100.200	ml/mol	McGowan Calculated Property
Pc	4403.25	kPa	Joback Calculated Property
Inp	[905.00; 905.00]
Inp	905.00		NIST
Inp	905.00		NIST
Tboil	453.61	K	Joback Calculated Property
Tc	683.63	K	Joback Calculated Property
Tfus	369.51	K	Joback Calculated Property
Vc	0.383	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[215.98; 293.87]	J/mol×K	[453.61; 683.63]
Cp,gas	215.98	J/mol×K	453.61	Joback Calculated Property
Cp,gas	231.26	J/mol×K	491.95	Joback Calculated Property
Cp,gas	245.48	J/mol×K	530.28	Joback Calculated Property
Cp,gas	258.74	J/mol×K	568.62	Joback Calculated Property
Cp,gas	271.16	J/mol×K	606.95	Joback Calculated Property
Cp,gas	282.83	J/mol×K	645.29	Joback Calculated Property
Cp,gas	293.87	J/mol×K	683.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Pyrazoline, 5-ethyl-5-methyl.

Sources

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

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