Chemical Properties of Hexanamide, N,N-bis(2-ethylhexyl)-6-bromo-

InChI

InChI=1S/C22H44BrNO/c1-5-9-14-20(7-3)18-24(19-21(8-4)15-10-6-2)22(25)16-12-11-13-17-23/h20-21H,5-19H2,1-4H3

InChI Key

KDQYJOXEUADVMC-UHFFFAOYSA-N

Formula

C22H44BrNO

SMILES

CCCCC(CC)CN(CC(CC)CCCC)C(=O)CCCCCBr

Molecular Weight¹

418.50

• 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°	125.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-526.69	kJ/mol	Joback Calculated Property
ΔfusH°	55.59	kJ/mol	Joback Calculated Property
ΔvapH°	79.01	kJ/mol	Joback Calculated Property
log10WS	-7.33		Crippen Calculated Property
logPoct/wat	7.203		Crippen Calculated Property
McVol	349.890	ml/mol	McGowan Calculated Property
Pc	986.40	kPa	Joback Calculated Property
Inp	[2469.00; 2469.00]
Inp	2469.00		NIST
Inp	2469.00		NIST
Tboil	834.35	K	Joback Calculated Property
Tc	1023.65	K	Joback Calculated Property
Tfus	449.90	K	Joback Calculated Property
Vc	1.341	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1098.30; 1202.81]	J/mol×K	[834.35; 1023.65]
Cp,gas	1098.30	J/mol×K	834.35	Joback Calculated Property
Cp,gas	1118.18	J/mol×K	865.90	Joback Calculated Property
Cp,gas	1136.99	J/mol×K	897.45	Joback Calculated Property
Cp,gas	1154.81	J/mol×K	929.00	Joback Calculated Property
Cp,gas	1171.67	J/mol×K	960.55	Joback Calculated Property
Cp,gas	1187.65	J/mol×K	992.10	Joback Calculated Property
Cp,gas	1202.81	J/mol×K	1023.65	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexanamide, N,N-bis(2-ethylhexyl)-6-bromo-.

Sources

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

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