Chemical Properties of 3-Ethyl-pyrrolidine

InChI

InChI=1S/C6H13N/c1-2-6-3-4-7-5-6/h6-7H,2-5H2,1H3

InChI Key

DZFFQSFNUBWNSF-UHFFFAOYSA-N

Formula

C6H13N

SMILES

CCC1CCNC1

Molecular Weight¹

99.17

Other Names

• Pyrrolidine, 3-ethyl

• 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°	123.90	kJ/mol	Joback Calculated Property
ΔfH°gas	-68.88	kJ/mol	Joback Calculated Property
ΔfusH°	14.82	kJ/mol	Joback Calculated Property
ΔvapH°	35.97	kJ/mol	Joback Calculated Property
log10WS	-1.18		Crippen Calculated Property
logPoct/wat	1.006		Crippen Calculated Property
McVol	94.520	ml/mol	McGowan Calculated Property
Pc	3960.52	kPa	Joback Calculated Property
Inp	[841.00; 841.00]
Inp	841.00		NIST
Inp	841.00		NIST
Inp	841.00		NIST
Tboil	400.51	K	Joback Calculated Property
Tc	605.61	K	Joback Calculated Property
Tfus	273.31	K	Joback Calculated Property
Vc	0.349	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[176.11; 252.38]	J/mol×K	[400.51; 605.61]
Cp,gas	176.11	J/mol×K	400.51	Joback Calculated Property
Cp,gas	190.42	J/mol×K	434.69	Joback Calculated Property
Cp,gas	204.06	J/mol×K	468.88	Joback Calculated Property
Cp,gas	217.07	J/mol×K	503.06	Joback Calculated Property
Cp,gas	229.45	J/mol×K	537.24	Joback Calculated Property
Cp,gas	241.21	J/mol×K	571.43	Joback Calculated Property
Cp,gas	252.38	J/mol×K	605.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Ethyl-pyrrolidine.

Sources

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

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