Chemical Properties of 1-Pentatriacontene (CAS 61868-13-1)

InChI

InChI=1S/C35H70/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-35H2,2H3

InChI Key

NOCIDIARFGFRSA-UHFFFAOYSA-N

Formula

C35H70

SMILES

C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Molecular Weight¹

490.93

CAS

61868-13-1

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• P_vap : Vapor 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°	331.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-640.30	kJ/mol	Joback Calculated Property
ΔfusH°	85.13	kJ/mol	Joback Calculated Property
ΔvapH°	92.83	kJ/mol	Joback Calculated Property
log10WS	-14.33		Crippen Calculated Property
logPoct/wat	13.675		Crippen Calculated Property
McVol	499.710	ml/mol	McGowan Calculated Property
Pc	486.02	kPa	Joback Calculated Property
Inp	[3484.00; 3490.00]
Inp	3484.00		NIST
Inp	3490.00		NIST
Tboil	996.88	K	Joback Calculated Property
Tc	1260.26	K	Joback Calculated Property
Tfus	482.45	K	Joback Calculated Property
Vc	1.976	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1794.09; 1961.53]	J/mol×K	[996.88; 1260.26]
Cp,gas	1794.09	J/mol×K	996.88	Joback Calculated Property
Cp,gas	1826.90	J/mol×K	1040.78	Joback Calculated Property
Cp,gas	1857.46	J/mol×K	1084.67	Joback Calculated Property
Cp,gas	1885.99	J/mol×K	1128.57	Joback Calculated Property
Cp,gas	1912.70	J/mol×K	1172.46	Joback Calculated Property
Cp,gas	1937.81	J/mol×K	1216.36	Joback Calculated Property
Cp,gas	1961.53	J/mol×K	1260.26	Joback Calculated Property
η	[0.0000121; 0.0005344]	Pa×s	[482.45; 996.88]
η	0.0005344	Pa×s	482.45	Joback Calculated Property
η	0.0001766	Pa×s	568.19	Joback Calculated Property
η	0.0000780	Pa×s	653.93	Joback Calculated Property
η	0.0000416	Pa×s	739.66	Joback Calculated Property
η	0.0000253	Pa×s	825.40	Joback Calculated Property
η	0.0000169	Pa×s	911.14	Joback Calculated Property
η	0.0000121	Pa×s	996.88	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[587.22; 812.47]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.49954e+01
Coefficient B			-6.38603e+03
Coefficient C			-1.53028e+02
Temperature range, min.			587.22
Temperature range, max.			812.47
Pvap	1.33	kPa	587.22	Calculated Property
Pvap	2.97	kPa	612.25	Calculated Property
Pvap	6.10	kPa	637.28	Calculated Property
Pvap	11.66	kPa	662.30	Calculated Property
Pvap	20.98	kPa	687.33	Calculated Property
Pvap	35.81	kPa	712.36	Calculated Property
Pvap	58.39	kPa	737.39	Calculated Property
Pvap	91.47	kPa	762.41	Calculated Property
Pvap	138.30	kPa	787.44	Calculated Property
Pvap	202.64	kPa	812.47	Calculated Property

Similar Compounds

Find more compounds similar to 1-Pentatriacontene.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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