Chemical Properties of Glutaric acid, monoamide, N-(1-adamantyl)-, propyl ester

InChI

InChI=1S/C18H29NO3/c1-2-6-22-17(21)5-3-4-16(20)19-18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,2-12H2,1H3,(H,19,20)

InChI Key

VCAQEJOVOOUBDC-UHFFFAOYSA-N

Formula

C18H29NO3

SMILES

CCCOC(=O)CCCC(=O)NC12CC3CC(CC(C3)C1)C2

Molecular Weight¹

307.43

• 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	0.7715		Relay (... Calculated Property
ΔfG°	-15.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-809.10	kJ/mol	Relay (... Calculated Property
ΔfusH°	38.94	kJ/mol	Joback Calculated Property
ΔvapH°	99.31	kJ/mol	Relay (... Calculated Property
IE	8.67	eV	Relay (... Calculated Property
log10WS	-4.49		Relay (... Calculated Property
logPoct/wat	3.195		Crippen Calculated Property
McVol	250.890	ml/mol	McGowan Calculated Property
Pc	1740.46	kPa	Joback Calculated Property
Inp	[2512.00; 2512.00]
Inp	2512.00		NIST
Inp	2512.00		NIST
Tboil	643.58	K	Relay (... Calculated Property
Tc	896.93	K	Relay (... Calculated Property
Tfus	450.60	K	Relay (... Calculated Property
Vc	0.930	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[836.91; 947.94]	J/mol×K	[811.63; 1022.12]
Cp,gas	836.91	J/mol×K	811.63	Joback Calculated Property
Cp,gas	856.21	J/mol×K	846.71	Joback Calculated Property
Cp,gas	874.95	J/mol×K	881.79	Joback Calculated Property
Cp,gas	893.32	J/mol×K	916.87	Joback Calculated Property
Cp,gas	911.49	J/mol×K	951.96	Joback Calculated Property
Cp,gas	929.64	J/mol×K	987.04	Joback Calculated Property
Cp,gas	947.94	J/mol×K	1022.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(1-adamantyl)-, propyl ester.

Sources

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

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