Chemical Properties of elvetil

InChI

InChI=1S/C20H25NO/c1-3-21(4-2)16-17-22-20-14-12-19(13-15-20)11-10-18-8-6-5-7-9-18/h5-15H,3-4,16-17H2,1-2H3/b11-10+

InChI Key

BXEBFKORKYWQLG-ZHACJKMWSA-N

Formula

C20H25NO

SMILES

CCN(CC)CCOc1ccc(C=Cc2ccccc2)cc1

Molecular Weight¹

295.42

• 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).
• 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
ΔfG°	418.71	kJ/mol	Joback Calculated Property
ΔfH°gas	57.99	kJ/mol	Joback Calculated Property
ΔfusH°	39.66	kJ/mol	Joback Calculated Property
ΔvapH°	69.74	kJ/mol	Joback Calculated Property
log10WS	-4.86		Crippen Calculated Property
logPoct/wat	4.578		Crippen Calculated Property
McVol	256.690	ml/mol	McGowan Calculated Property
Pc	1655.15	kPa	Joback Calculated Property
Inp	[2485.00; 2515.00]
Inp	2485.00		NIST
Inp	2515.00		NIST
Tboil	754.36	K	Joback Calculated Property
Tc	972.36	K	Joback Calculated Property
Tfus	430.14	K	Joback Calculated Property
Vc	0.956	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[734.85; 827.76]	J/mol×K	[754.36; 972.36]
Cp,gas	734.85	J/mol×K	754.36	Joback Calculated Property
Cp,gas	753.19	J/mol×K	790.69	Joback Calculated Property
Cp,gas	770.28	J/mol×K	827.03	Joback Calculated Property
Cp,gas	786.20	J/mol×K	863.36	Joback Calculated Property
Cp,gas	801.04	J/mol×K	899.70	Joback Calculated Property
Cp,gas	814.86	J/mol×K	936.03	Joback Calculated Property
Cp,gas	827.76	J/mol×K	972.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to elvetil.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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