Chemical Properties of Adamantan-4-one, 1-amino

InChI

InChI=1S/C10H15NO/c11-10-3-6-1-7(4-10)9(12)8(2-6)5-10/h6-8H,1-5,11H2

InChI Key

FXBKMQRDMLOJNV-UHFFFAOYSA-N

Formula

C10H15NO

SMILES

NC12CC3CC(C1)C(=O)C(C3)C2

Molecular Weight¹

165.23

• 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	0.4467		Relay (1.0) Calculated Property
ΔfG°	134.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-201.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.44	kJ/mol	Joback Calculated Property
ΔvapH°	65.27	kJ/mol	Relay (1.0) Calculated Property
IE	8.20	eV	Relay (1.0) Calculated Property
log10WS	-2.89		Relay (1.0) Calculated Property
logPoct/wat	1.093		Crippen Calculated Property
McVol	130.730	ml/mol	McGowan Calculated Property
Pc	3633.35	kPa	Joback Calculated Property
Inp	[1490.00; 1490.00]
Inp	1490.00		NIST
Inp	1490.00		NIST
Tboil	524.36	K	Relay (1.0) Calculated Property
Tc	800.25	K	Relay (1.0) Calculated Property
Tfus	471.64	K	Relay (1.0) Calculated Property
Vc	0.470	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[374.64; 469.90]	J/mol×K	[588.61; 838.61]
Cp,gas	374.64	J/mol×K	588.61	Joback Calculated Property
Cp,gas	393.05	J/mol×K	630.28	Joback Calculated Property
Cp,gas	410.14	J/mol×K	671.94	Joback Calculated Property
Cp,gas	426.13	J/mol×K	713.61	Joback Calculated Property
Cp,gas	441.27	J/mol×K	755.28	Joback Calculated Property
Cp,gas	455.78	J/mol×K	796.95	Joback Calculated Property
Cp,gas	469.90	J/mol×K	838.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to Adamantan-4-one, 1-amino.

Sources

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

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