Chemical Properties of Nortropan-3«beta»-ol

InChI

InChI=1S/C7H13NO/c9-7-3-5-1-2-6(4-7)8-5/h5-9H,1-4H2/t5-,6+,7-

InChI Key

YYMCYJLIYNNOMK-KVSKUHBBSA-N

Formula

C7H13NO

SMILES

OC1CC2CCC(C1)N2

Molecular Weight¹

127.18

• 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	0.5225		Relay (1.0) Calculated Property
ΔfG°	48.54	kJ/mol	Joback Calculated Property
ΔfH°gas	-230.79	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	20.71	kJ/mol	Joback Calculated Property
ΔvapH°	73.82	kJ/mol	Relay (1.0) Calculated Property
IE	8.05	eV	Relay (1.0) Calculated Property
log10WS	-0.62		Relay (1.0) Calculated Property
logPoct/wat	0.262		Crippen Calculated Property
McVol	103.620	ml/mol	McGowan Calculated Property
Pc	4468.24	kPa	Joback Calculated Property
Inp	[1160.00; 1160.00]
Inp	1160.00		NIST
Inp	1160.00		NIST
Tboil	501.06	K	Relay (1.0) Calculated Property
Tc	737.39	K	Relay (1.0) Calculated Property
Tfus	458.32	K	Relay (1.0) Calculated Property
Vc	0.386	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[259.65; 334.53]	J/mol×K	[517.64; 723.80]
Cp,gas	259.65	J/mol×K	517.64	Joback Calculated Property
Cp,gas	274.10	J/mol×K	552.00	Joback Calculated Property
Cp,gas	287.71	J/mol×K	586.36	Joback Calculated Property
Cp,gas	300.51	J/mol×K	620.72	Joback Calculated Property
Cp,gas	312.56	J/mol×K	655.08	Joback Calculated Property
Cp,gas	323.89	J/mol×K	689.44	Joback Calculated Property
Cp,gas	334.53	J/mol×K	723.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to Nortropan-3«beta»-ol.

Sources

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

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