Chemical Properties of Benzene, (3-methylpentyl)- (CAS 54410-69-4)

InChI

InChI=1S/C12H18/c1-3-11(2)9-10-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3

InChI Key

PVXCNEZDIJHZQB-UHFFFAOYSA-N

Formula

C12H18

SMILES

CCC(C)CCc1ccccc1

Molecular Weight¹

162.27

CAS

54410-69-4

Other Names

• (3-Methylpentyl)benzene

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[345.64; 436.08]	J/mol×K	[500.20; 703.92]
Cp,gas	345.64	J/mol×K	500.20	Joback Calculated Property
Cp,gas	362.97	J/mol×K	534.15	Joback Calculated Property
Cp,gas	379.35	J/mol×K	568.11	Joback Calculated Property
Cp,gas	394.81	J/mol×K	602.06	Joback Calculated Property
Cp,gas	409.40	J/mol×K	636.01	Joback Calculated Property
Cp,gas	423.14	J/mol×K	669.96	Joback Calculated Property
Cp,gas	436.08	J/mol×K	703.92	Joback Calculated Property
η	[0.0001961; 0.0057131]	Pa×s	[236.42; 500.20]
η	0.0057131	Pa×s	236.42	Joback Calculated Property
η	0.0020964	Pa×s	280.38	Joback Calculated Property
η	0.0010095	Pa×s	324.35	Joback Calculated Property
η	0.0005788	Pa×s	368.31	Joback Calculated Property
η	0.0003736	Pa×s	412.27	Joback Calculated Property
η	0.0002624	Pa×s	456.24	Joback Calculated Property
η	0.0001961	Pa×s	500.20	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[369.02; 523.58]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.47631e+01
Coefficient B			-4.20909e+03
Coefficient C			-7.82460e+01
Temperature range, min.			369.02
Temperature range, max.			523.58
Pvap	1.33	kPa	369.02	Calculated Property
Pvap	2.99	kPa	386.19	Calculated Property
Pvap	6.15	kPa	403.37	Calculated Property
Pvap	11.78	kPa	420.54	Calculated Property
Pvap	21.20	kPa	437.71	Calculated Property
Pvap	36.15	kPa	454.89	Calculated Property
Pvap	58.85	kPa	472.06	Calculated Property
Pvap	91.99	kPa	489.23	Calculated Property
Pvap	138.72	kPa	506.41	Calculated Property
Pvap	202.66	kPa	523.58	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (3-methylpentyl)-.

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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