Chemical Properties of 20-Methyl-hentriacontyl cyanide

InChI

InChI=1S/C33H65N/c1-3-4-5-6-7-18-21-24-27-30-33(2)31-28-25-22-19-16-14-12-10-8-9-11-13-15-17-20-23-26-29-32-34/h33H,3-31H2,1-2H3

InChI Key

IUPJCSSBXBHZBM-UHFFFAOYSA-N

Formula

C33H65N

SMILES

CCCCCCCCCCCC(C)CCCCCCCCCCCCCCCCCCCC#N

Molecular Weight¹

475.88

• 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	1.3637		Relay (1.0) Calculated Property
ΔfG°	357.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-603.21	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	79.21	kJ/mol	Joback Calculated Property
ΔvapH°	166.07	kJ/mol	Relay (1.0) Calculated Property
IE	10.88	eV	Relay (1.0) Calculated Property
log10WS	-11.67		Relay (1.0) Calculated Property
logPoct/wat	12.479		Crippen Calculated Property
McVol	477.210	ml/mol	McGowan Calculated Property
Pc	515.83	kPa	Joback Calculated Property
Inp	[3589.00; 3589.00]
Inp	3589.00		NIST
Inp	3589.00		NIST
Tboil	696.17	K	Relay (1.0) Calculated Property
Tc	904.31	K	Relay (1.0) Calculated Property
Tfus	325.71	K	Relay (1.0) Calculated Property
Vc	1.838	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1737.14; 1883.28]	J/mol×K	[1056.08; 1334.66]
Cp,gas	1737.14	J/mol×K	1056.08	Joback Calculated Property
Cp,gas	1766.19	J/mol×K	1102.51	Joback Calculated Property
Cp,gas	1793.05	J/mol×K	1148.94	Joback Calculated Property
Cp,gas	1817.97	J/mol×K	1195.37	Joback Calculated Property
Cp,gas	1841.16	J/mol×K	1241.80	Joback Calculated Property
Cp,gas	1862.86	J/mol×K	1288.23	Joback Calculated Property
Cp,gas	1883.28	J/mol×K	1334.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to 20-Methyl-hentriacontyl cyanide.

Sources

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

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