Chemical Properties of 1-Nonacosene (CAS 18835-35-3)

InChI

InChI=1S/C29H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-29H2,2H3

InChI Key

UBMJSQAFNUWJEG-UHFFFAOYSA-N

Formula

C29H52

SMILES

C=CCCCCCCCCCCCCCCCCCCCCCCCCCCC

Molecular Weight¹

400.72

CAS

18835-35-3

• ω : Acentric Factor.
• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• 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
ω	1.1411		Relay (1.0) Calculated Property
ΔfG°	281.14	kJ/mol	Joback Calculated Property
ΔfH°gas	-534.38	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	69.59	kJ/mol	Joback Calculated Property
ΔvapH°	143.67	kJ/mol	Relay (1.0) Calculated Property
IE	9.97	eV	Relay (1.0) Calculated Property
log10WS	-10.77		Relay (1.0) Calculated Property
logPoct/wat	11.335		Crippen Calculated Property
McVol	415.170	ml/mol	McGowan Calculated Property
Pc	637.69	kPa	Joback Calculated Property
Inp	[2877.00; 2894.00]
Inp	2884.70		NIST
Inp	2888.00		NIST
Inp	2877.00		NIST
Inp	2894.00		NIST
Tboil	658.35	K	Relay (1.0) Calculated Property
Tc	812.37	K	Relay (1.0) Calculated Property
Tfus	318.92	K	Relay (1.0) Calculated Property
Vc	1.645	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1385.92; 1520.75]	J/mol×K	[859.60; 1055.27]
Cp,gas	1385.92	J/mol×K	859.60	Joback Calculated Property
Cp,gas	1411.53	J/mol×K	892.21	Joback Calculated Property
Cp,gas	1435.79	J/mol×K	924.82	Joback Calculated Property
Cp,gas	1458.77	J/mol×K	957.43	Joback Calculated Property
Cp,gas	1480.54	J/mol×K	990.05	Joback Calculated Property
Cp,gas	1501.18	J/mol×K	1022.66	Joback Calculated Property
Cp,gas	1520.75	J/mol×K	1055.27	Joback Calculated Property
η	[0.0000303; 0.0012385]	Pa×s	[414.83; 859.60]
η	0.0012385	Pa×s	414.83	Joback Calculated Property
η	0.0004174	Pa×s	488.96	Joback Calculated Property
η	0.0001873	Pa×s	563.09	Joback Calculated Property
η	0.0001013	Pa×s	637.22	Joback Calculated Property
η	0.0000623	Pa×s	711.34	Joback Calculated Property
η	0.0000420	Pa×s	785.47	Joback Calculated Property
η	0.0000303	Pa×s	859.60	Joback Calculated Property
ΔvapH	113.30	kJ/mol	584.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[539.96; 759.92]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.16621e+01
Coefficient B			-3.16266e+03
Coefficient C			-2.61912e+02
Temperature range, min.			539.96
Temperature range, max.			759.92
Pvap	1.33	kPa	539.96	Calculated Property
Pvap	3.34	kPa	564.40	Calculated Property
Pvap	7.30	kPa	588.84	Calculated Property
Pvap	14.31	kPa	613.28	Calculated Property
Pvap	25.70	kPa	637.72	Calculated Property
Pvap	42.96	kPa	662.16	Calculated Property
Pvap	67.70	kPa	686.60	Calculated Property
Pvap	101.52	kPa	711.04	Calculated Property
Pvap	146.02	kPa	735.48	Calculated Property
Pvap	202.65	kPa	759.92	Calculated Property

Similar Compounds

Find more compounds similar to 1-Nonacosene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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