Chemical Properties of 5-Undecanone, 2-methyl- (CAS 50639-02-6)

InChI

InChI=1S/C12H24O/c1-4-5-6-7-8-12(13)10-9-11(2)3/h11H,4-10H2,1-3H3

InChI Key

JLTHSCDXCKBHCZ-UHFFFAOYSA-N

Formula

C12H24O

SMILES

CCCCCCC(=O)CCC(C)C

Molecular Weight¹

184.32

CAS

50639-02-6

Other Names

• 2-Methyl-5-undecanone

• 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).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[436.53; 524.50]	J/mol×K	[527.39; 700.81]
Cp,gas	436.53	J/mol×K	527.39	Joback Calculated Property
Cp,gas	452.84	J/mol×K	556.29	Joback Calculated Property
Cp,gas	468.47	J/mol×K	585.20	Joback Calculated Property
Cp,gas	483.44	J/mol×K	614.10	Joback Calculated Property
Cp,gas	497.75	J/mol×K	643.00	Joback Calculated Property
Cp,gas	511.43	J/mol×K	671.91	Joback Calculated Property
Cp,gas	524.50	J/mol×K	700.81	Joback Calculated Property
η	[0.0002185; 0.0063181]	Pa×s	[259.93; 527.39]
η	0.0063181	Pa×s	259.93	Joback Calculated Property
η	0.0023924	Pa×s	304.51	Joback Calculated Property
η	0.0011609	Pa×s	349.08	Joback Calculated Property
η	0.0006635	Pa×s	393.66	Joback Calculated Property
η	0.0004250	Pa×s	438.24	Joback Calculated Property
η	0.0002955	Pa×s	482.81	Joback Calculated Property
η	0.0002185	Pa×s	527.39	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[384.84; 548.95]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.45662e+01
Coefficient B			-4.31660e+03
Coefficient C			-8.25270e+01
Temperature range, min.			384.84
Temperature range, max.			548.95
Pvap	1.33	kPa	384.84	Calculated Property
Pvap	3.00	kPa	403.07	Calculated Property
Pvap	6.20	kPa	421.31	Calculated Property
Pvap	11.89	kPa	439.54	Calculated Property
Pvap	21.39	kPa	457.78	Calculated Property
Pvap	36.45	kPa	476.01	Calculated Property
Pvap	59.26	kPa	494.25	Calculated Property
Pvap	92.43	kPa	512.48	Calculated Property
Pvap	139.07	kPa	530.72	Calculated Property
Pvap	202.65	kPa	548.95	Calculated Property

Similar Compounds

Find more compounds similar to 5-Undecanone, 2-methyl-.

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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