Chemical Properties of Carbonic acid, monoamide, N-octyl-, hexyl ester

InChI

InChI=1S/C14H29NO2/c1-3-5-7-9-10-12-15-14(16)17-13-11-8-6-4-2/h3-13H2,1-2H3,(H,15,16)

InChI Key

RONSWADFFUQVDH-UHFFFAOYSA-N

Formula

C14H29NO2

SMILES

CCCCCCCNC(=O)OCCCCCC

Molecular Weight¹

243.39

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.8364		Relay (1.0) Calculated Property
ΔfG°	-77.53	kJ/mol	Joback Calculated Property
ΔfH°gas	-662.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.90	kJ/mol	Joback Calculated Property
ΔvapH°	86.27	kJ/mol	Relay (1.0) Calculated Property
IE	9.17	eV	Relay (1.0) Calculated Property
log10WS	-4.50		Relay (1.0) Calculated Property
logPoct/wat	4.263		Crippen Calculated Property
McVol	225.540	ml/mol	McGowan Calculated Property
Pc	1596.17	kPa	Joback Calculated Property
Inp	[1821.00; 1821.00]
Inp	1821.00		NIST
Inp	1821.00		NIST
Tboil	561.77	K	Relay (1.0) Calculated Property
Tc	754.40	K	Relay (1.0) Calculated Property
Tfus	275.04	K	Relay (1.0) Calculated Property
Vc	0.868	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[627.35; 716.80]	J/mol×K	[646.18; 817.40]
Cp,gas	627.35	J/mol×K	646.18	Joback Calculated Property
Cp,gas	644.05	J/mol×K	674.72	Joback Calculated Property
Cp,gas	660.01	J/mol×K	703.25	Joback Calculated Property
Cp,gas	675.25	J/mol×K	731.79	Joback Calculated Property
Cp,gas	689.78	J/mol×K	760.33	Joback Calculated Property
Cp,gas	703.63	J/mol×K	788.86	Joback Calculated Property
Cp,gas	716.80	J/mol×K	817.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, monoamide, N-octyl-, hexyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.