Chemical Properties of 2-Propaneamine, N,N-diethyl- (CAS 6006-15-1)

InChI

InChI=1S/C7H17N/c1-5-8(6-2)7(3)4/h7H,5-6H2,1-4H3

InChI Key

ULWOJODHECIZAU-UHFFFAOYSA-N

Formula

C7H17N

SMILES

CCN(CC)C(C)C

Molecular Weight¹

115.22

CAS

6006-15-1

Other Names

• (i-C3H7)N(C2H5)2
• 2-Propanamine, N,N-diethyl-
• Diethylisopropylamine

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• 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).
• P_vap : Vapor 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
PAff	996.40	kJ/mol	NIST
BasG	965.60	kJ/mol	NIST
ΔfG°	116.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-125.56	kJ/mol	Joback Calculated Property
ΔfusH°	13.38	kJ/mol	Joback Calculated Property
ΔvapH°	32.83	kJ/mol	Joback Calculated Property
log10WS	-1.43		Crippen Calculated Property
logPoct/wat	1.737		Crippen Calculated Property
McVol	119.470	ml/mol	McGowan Calculated Property
Pc	2817.33	kPa	Joback Calculated Property
Inp	[737.00; 742.00]
Inp	742.00		NIST
Inp	737.00		NIST
Tboil	381.65 ± 3.00	K	NIST
Tc	537.88	K	Joback Calculated Property
Tfus	186.12	K	Joback Calculated Property
Vc	0.440	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[221.23; 293.92]	J/mol×K	[371.56; 537.88]
Cp,gas	221.23	J/mol×K	371.56	Joback Calculated Property
Cp,gas	234.61	J/mol×K	399.28	Joback Calculated Property
Cp,gas	247.47	J/mol×K	427.00	Joback Calculated Property
Cp,gas	259.82	J/mol×K	454.72	Joback Calculated Property
Cp,gas	271.66	J/mol×K	482.44	Joback Calculated Property
Cp,gas	283.03	J/mol×K	510.16	Joback Calculated Property
Cp,gas	293.92	J/mol×K	537.88	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[287.32; 404.09]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.56401e+01
Coefficient B			-3.68570e+03
Coefficient C			-4.72490e+01
Temperature range, min.			287.32
Temperature range, max.			404.09
Pvap	1.33	kPa	287.32	Calculated Property
Pvap	2.93	kPa	300.29	Calculated Property
Pvap	5.96	kPa	313.27	Calculated Property
Pvap	11.35	kPa	326.24	Calculated Property
Pvap	20.42	kPa	339.22	Calculated Property
Pvap	34.94	kPa	352.19	Calculated Property
Pvap	57.22	kPa	365.17	Calculated Property
Pvap	90.15	kPa	378.14	Calculated Property
Pvap	137.24	kPa	391.12	Calculated Property
Pvap	202.64	kPa	404.09	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propaneamine, N,N-diethyl-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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