Chemical Properties of Di(3-Methylbutyl)amine (CAS 544-00-3)

InChI

InChI=1S/C10H23N/c1-9(2)5-7-11-8-6-10(3)4/h9-11H,5-8H2,1-4H3

InChI Key

SPVVMXMTSODFPU-UHFFFAOYSA-N

Formula

C10H23N

SMILES

CC(C)CCNCCC(C)C

Molecular Weight¹

157.30

CAS

544-00-3

Other Names

• 1-Butanamine, 3-methyl-N-(3-methylbutyl)-
• Diisoamylamine
• Diisopentylamine

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (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_fH°_liquid : Liquid phase 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
ΔcH°liquid	-6974.30	kJ/mol	NIST
ΔfG°	117.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-206.82	kJ/mol	Joback Calculated Property
ΔfH°liquid	-248.00	kJ/mol	NIST
ΔfusH°	19.71	kJ/mol	Joback Calculated Property
ΔvapH°	43.51	kJ/mol	Joback Calculated Property
log10WS	-2.71		Crippen Calculated Property
logPoct/wat	2.668		Crippen Calculated Property
McVol	161.740	ml/mol	McGowan Calculated Property
Pc	2165.35	kPa	Joback Calculated Property
Inp	[1046.00; 1061.00]
Inp	1061.00		NIST
Inp	1046.00		NIST
Inp	1061.00		NIST
Tboil	461.20	K	NIST
Tc	650.76	K	Joback Calculated Property
Tfus	225.12	K	Joback Calculated Property
Vc	0.619	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[368.34; 455.97]	J/mol×K	[477.49; 650.76]
Cp,gas	368.34	J/mol×K	477.49	Joback Calculated Property
Cp,gas	384.54	J/mol×K	506.37	Joback Calculated Property
Cp,gas	400.08	J/mol×K	535.25	Joback Calculated Property
Cp,gas	414.98	J/mol×K	564.12	Joback Calculated Property
Cp,gas	429.25	J/mol×K	593.00	Joback Calculated Property
Cp,gas	442.91	J/mol×K	621.88	Joback Calculated Property
Cp,gas	455.97	J/mol×K	650.76	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[350.92; 487.41]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.56757e+01
Coefficient B			-4.33283e+03
Coefficient C			-6.93500e+01
Temperature range, min.			350.92
Temperature range, max.			487.41
Pvap	1.33	kPa	350.92	Calculated Property
Pvap	2.93	kPa	366.09	Calculated Property
Pvap	5.95	kPa	381.25	Calculated Property
Pvap	11.34	kPa	396.42	Calculated Property
Pvap	20.39	kPa	411.58	Calculated Property
Pvap	34.90	kPa	426.75	Calculated Property
Pvap	57.16	kPa	441.91	Calculated Property
Pvap	90.09	kPa	457.08	Calculated Property
Pvap	137.20	kPa	472.24	Calculated Property
Pvap	202.66	kPa	487.41	Calculated Property

Similar Compounds

Find more compounds similar to Di(3-Methylbutyl)amine.

Sources

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

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