Chemical Properties of Adamantane, 2-(4-morpholyl)

InChI

InChI=1S/C14H23NO/c1-3-16-4-2-15(1)14-12-6-10-5-11(8-12)9-13(14)7-10/h10-14H,1-9H2

InChI Key

YVVBYCGUFRPWSH-UHFFFAOYSA-N

Formula

C14H23NO

SMILES

C1CN(C2C3CC4CC(C3)CC2C4)CCO1

Molecular Weight¹

221.34

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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	0.4382		Relay (1.0) Calculated Property
ΔfG°	157.52	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-242.50	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	71.57	kJ/mol	Relay (1.0) Calculated Property
IE	7.66	eV	Relay (1.0) Calculated Property
log10WS	-3.17		Relay (1.0) Calculated Property
logPoct/wat	2.143		Crippen Calculated Property
McVol	180.530	ml/mol	McGowan Calculated Property
Pc	2090.91	kPa	Relay (1.0-beta) Calculated Property
Inp	[1783.00; 1783.00]
Inp	1783.00		NIST
Inp	1783.00		NIST
Tboil	581.16	K	Relay (1.0) Calculated Property
Tc	842.73	K	Relay (1.0) Calculated Property
Tfus	513.16	K	Relay (1.0) Calculated Property
Vc	0.676	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Adamantane, 2-(4-morpholyl).

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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