Chemical Properties of 3-Azabicyclo[3.2.2]nonane (CAS 283-24-9)

InChI

InChI=1S/C8H15N/c1-2-8-4-3-7(1)5-9-6-8/h7-9H,1-6H2

InChI Key

LICHZOBEUWVYSY-UHFFFAOYSA-N

Formula

C8H15N

SMILES

C1CC2CCC1CNC2

Molecular Weight¹

125.21

CAS

283-24-9

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	-5190.29 ± 0.67	kJ/mol	NIST
ΔfH°gas	-43.68 ± 0.79	kJ/mol	NIST
ΔfH°solid	-101.60 ± 0.67	kJ/mol	NIST
ΔfusH°	16.04	kJ/mol	Joback Calculated Property
ΔsubH°	[57.80; 57.90]	kJ/mol
ΔsubH°	57.90	kJ/mol	NIST
ΔsubH°	57.80 ± 1.30	kJ/mol	NIST
IE	7.81	eV	Relay (1.0) Calculated Property
logPoct/wat	1.396		Crippen Calculated Property
McVol	111.840	ml/mol	McGowan Calculated Property
S°solid,1 bar	245.73	J/mol×K	NIST
Tfus	519.15	K	Relay (1.0) Calculated Property
Ttriple	[467.12; 467.12]	K
Ttriple	467.12 ± 0.01	K	NIST
Ttriple	467.12 ± 0.01	K	NIST

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[243.74; 342.97]	J/mol×K	[457.48; 684.33]
Cp,gas	243.74	J/mol×K	457.48	Joback Calculated Property
Cp,gas	263.07	J/mol×K	495.29	Joback Calculated Property
Cp,gas	281.21	J/mol×K	533.10	Joback Calculated Property
Cp,gas	298.22	J/mol×K	570.91	Joback Calculated Property
Cp,gas	314.15	J/mol×K	608.72	Joback Calculated Property
Cp,gas	329.05	J/mol×K	646.52	Joback Calculated Property
Cp,gas	342.97	J/mol×K	684.33	Joback Calculated Property
Cp,solid	[237.80; 239.03]	J/mol×K	[310.00; 350.00]
Cp,solid	239.03	J/mol×K	310.00	NIST
Cp,solid	237.80	J/mol×K	350.00	NIST
ΔfusH	[6.92; 14.55]	kJ/mol	[297.80; 466.60]
ΔfusH	14.55	kJ/mol	297.80	NIST
ΔfusH	6.92	kJ/mol	466.60	NIST
ΔfusH	6.92	kJ/mol	466.60	NIST
ΔvapH	52.20	kJ/mol	373.00	NIST
ΔfusS	[14.82; 48.87]	J/mol×K	[297.80; 466.60]
ΔfusS	48.87	J/mol×K	297.80	NIST
ΔfusS	14.82	J/mol×K	466.60	NIST

Similar Compounds

Find more compounds similar to 3-Azabicyclo[3.2.2]nonane.

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
• 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.
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