Chemical Properties of Nonane, 4-methyl- (CAS 17301-94-9)

InChI

InChI=1S/C10H22/c1-4-6-7-9-10(3)8-5-2/h10H,4-9H2,1-3H3

InChI Key

IALRSQMWHFKJJA-UHFFFAOYSA-N

Formula

C10H22

SMILES

CCCCCC(C)CCC

Molecular Weight¹

142.28

CAS

17301-94-9

Other Names

• 4-Methylnonane
• 4-Methylnonane, (DL)-
• n-C3H7CH(CH3)(CH2)4CH3

• ω : Acentric Factor.
• AP : Aniline Point (K).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_c,grossH : Heat of Combustion, Gross form (kJ/mol).
• Δ_c,netH : Heat of Combustion, Net Form (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• n₀ : Refractive Index.
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4510		KDB
AP	351.450	K	KDB
ΔfG°	30.88	kJ/mol	Joback Calculated Property
Δc,grossH	6775.57	kJ/mol	KDB
Δc,netH	6291.439	kJ/mol	KDB
ΔfH°gas	-255.01	kJ/mol	Joback Calculated Property
ΔfusH°	18.13	kJ/mol	Joback Calculated Property
ΔvapH°	49.50	kJ/mol	NIST
log10WS	-3.77		Crippen Calculated Property
logPoct/wat	4.003		Crippen Calculated Property
McVol	151.760	ml/mol	McGowan Calculated Property
Pc	2140.00	kPa	KDB
Inp	[955.00; 972.00]
Inp	960.00		NIST
Inp	Outlier 972.00		NIST
Inp	965.00		NIST
Inp	960.00		NIST
Inp	964.00		NIST
Inp	Outlier 970.00		NIST
Inp	Outlier 970.00		NIST
Inp	962.50		NIST
Inp	962.40		NIST
Inp	960.00		NIST
Inp	959.30		NIST
Inp	960.00		NIST
Inp	960.80		NIST
Inp	965.00		NIST
Inp	964.00		NIST
Inp	966.00		NIST
Inp	968.00		NIST
Inp	963.00		NIST
Inp	958.00		NIST
Inp	960.63		NIST
Inp	960.63		NIST
Inp	961.00		NIST
Inp	960.00		NIST
Inp	961.00		NIST
Inp	962.40		NIST
Inp	962.00		NIST
Inp	Outlier 955.00		NIST
Inp	961.00		NIST
Inp	967.00		NIST
Inp	960.00		NIST
Inp	963.80		NIST
Inp	962.10		NIST
Inp	961.60		NIST
Inp	962.00		NIST
Inp	963.54		NIST
Inp	963.12		NIST
Inp	963.33		NIST
Inp	963.34		NIST
Inp	962.48		NIST
Inp	962.63		NIST
Inp	962.67		NIST
Inp	Outlier 955.00		NIST
Inp	958.00		NIST
Inp	962.00		NIST
Inp	963.00		NIST
Inp	961.00		NIST
Inp	964.00		NIST
Inp	961.00		NIST
Inp	958.00		NIST
Inp	962.00		NIST
Inp	964.00		NIST
Inp	966.00		NIST
Inp	964.00		NIST
Inp	962.80		NIST
Inp	963.00		NIST
Inp	960.00		NIST
Inp	963.00		NIST
Inp	964.00		NIST
Inp	960.00		NIST
Inp	960.00		NIST
Inp	962.00		NIST
Inp	962.00		NIST
Inp	961.00		NIST
Inp	963.00		NIST
Inp	962.00		NIST
S°liquid	425.50	J/mol×K	NIST
Tboil	[438.85; 442.15]	K
Tboil	438.90	K	KDB
Tboil	441.15 ± 2.00	K	NIST
Tboil	438.85 ± 0.50	K	NIST
Tboil	438.90 ± 0.50	K	NIST
Tboil	442.15 ± 2.00	K	NIST
Tboil	438.90 ± 0.50	K	NIST
Tboil	438.90 ± 0.30	K	NIST
Tc	610.50	K	KDB
Tfus	[171.53; 174.69]	K
Tfus	174.00	K	KDB
Tfus	174.69 ± 0.20	K	NIST
Tfus	171.53 ± 0.15	K	NIST
Ttriple	174.70 ± 0.20	K	NIST
Vc	0.575	m3/kmol	KDB
Zc	0.2424150		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[315.29; 399.91]	J/mol×K	[427.76; 593.73]
Cp,gas	315.29	J/mol×K	427.76	Joback Calculated Property
Cp,gas	330.79	J/mol×K	455.42	Joback Calculated Property
Cp,gas	345.71	J/mol×K	483.08	Joback Calculated Property
Cp,gas	360.07	J/mol×K	510.75	Joback Calculated Property
Cp,gas	373.88	J/mol×K	538.41	Joback Calculated Property
Cp,gas	387.16	J/mol×K	566.07	Joback Calculated Property
Cp,gas	399.91	J/mol×K	593.73	Joback Calculated Property
Cp,liquid	317.36	J/mol×K	298.10	NIST
η	[0.0002265; 0.0108083]	Pa×s	[187.46; 427.76]
η	0.0108083	Pa×s	187.46	Joback Calculated Property
η	0.0032190	Pa×s	227.51	Joback Calculated Property
η	0.0013777	Pa×s	267.56	Joback Calculated Property
η	0.0007355	Pa×s	307.61	Joback Calculated Property
η	0.0004537	Pa×s	347.66	Joback Calculated Property
η	0.0003093	Pa×s	387.71	Joback Calculated Property
η	0.0002265	Pa×s	427.76	Joback Calculated Property
ΔfusH	[15.19; 15.19]	kJ/mol	[174.70; 174.70]
ΔfusH	15.19	kJ/mol	174.70	NIST
ΔfusH	15.19	kJ/mol	174.70	NIST
ΔvapH	38.79	kJ/mol	438.90	KDB
n0	1.40950		298.15	KDB
ρl	[626.00; 739.36]	kg/m3	[283.15; 423.15]
ρl	739.36	kg/m3	283.15	Viscosi...
ρl	735.55	kg/m3	288.15	Viscosi...
ρl	731.74	kg/m3	293.15	Viscosi...
ρl	727.93	kg/m3	298.15	Viscosi...
ρl	728.35	kg/m3	298.15	Viscosi...
ρl	724.10	kg/m3	303.15	Viscosi...
ρl	720.25	kg/m3	308.15	Viscosi...
ρl	716.40	kg/m3	313.15	Viscosi...
ρl	712.53	kg/m3	318.15	Viscosi...
ρl	708.63	kg/m3	323.15	Viscosi...
ρl	708.82	kg/m3	323.15	Viscosi...
ρl	704.73	kg/m3	328.15	Viscosi...
ρl	700.81	kg/m3	333.15	Viscosi...
ρl	696.87	kg/m3	338.15	Viscosi...
ρl	692.92	kg/m3	343.15	Viscosi...
ρl	688.94	kg/m3	348.15	Viscosi...
ρl	689.00	kg/m3	348.15	Viscosi...
ρl	684.94	kg/m3	353.15	Viscosi...
ρl	680.92	kg/m3	358.15	Viscosi...
ρl	676.88	kg/m3	363.15	Viscosi...
ρl	668.81	kg/m3	373.15	Viscosi...
ρl	647.86	kg/m3	398.15	Viscosi...
ρl	626.00	kg/m3	423.15	Viscosi...
ΔfusS	86.94	J/mol×K	174.70	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[320.68; 467.87]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.47150e+01
Coefficient B			-3.97462e+03
Coefficient C			-4.51930e+01
Temperature range, min.			320.68
Temperature range, max.			467.87
Pvap	1.33	kPa	320.68	Calculated Property
Pvap	2.99	kPa	337.03	Calculated Property
Pvap	6.16	kPa	353.39	Calculated Property
Pvap	11.80	kPa	369.74	Calculated Property
Pvap	21.24	kPa	386.10	Calculated Property
Pvap	36.22	kPa	402.45	Calculated Property
Pvap	58.95	kPa	418.81	Calculated Property
Pvap	92.10	kPa	435.16	Calculated Property
Pvap	138.80	kPa	451.52	Calculated Property
Pvap	202.66	kPa	467.87	Calculated Property
Pvap	[1.05e-07; 2093.44]	kPa	[174.45; 610.00]	KDB Vap...
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			7.38814e+01
Coefficient B			-8.08283e+03
Coefficient C			-8.47077e+00
Coefficient D			3.60829e-06
Temperature range, min.			174.45
Temperature range, max.			610.00
Pvap	1.05e-07	kPa	174.45	Calculated Property
Pvap	3.33e-04	kPa	222.84	Calculated Property
Pvap	0.04	kPa	271.24	Calculated Property
Pvap	1.12	kPa	319.63	Calculated Property
Pvap	10.60	kPa	368.03	Calculated Property
Pvap	54.80	kPa	416.42	Calculated Property
Pvap	190.04	kPa	464.82	Calculated Property
Pvap	502.11	kPa	513.21	Calculated Property
Pvap	1097.01	kPa	561.61	Calculated Property
Pvap	2093.44	kPa	610.00	Calculated Property

Similar Compounds

Find more compounds similar to Nonane, 4-methyl-.

Mixtures

• Nonane, 4-methyl- + Octacosane

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Crippen Method
• Viscosity and Surface Tension of Branched Alkanes 2-Methylnonane and 4-Methylnonane
• Liquid Viscosity and Interfacial Tension of Binary and Ternary Mixtures Containing n-Octacosane by Surface Light Scattering
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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