Chemical Properties of Benzene, 1-(1,5-dimethylhexyl)-4-methyl- (CAS 1461-02-5)

InChI

InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h8-12,14H,5-7H2,1-4H3

InChI Key

GVCHCLNHTASCCP-UHFFFAOYSA-N

Formula

C15H24

SMILES

Cc1ccc(C(C)CCCC(C)C)cc1

Molecular Weight¹

204.35

CAS

1461-02-5

Other Names

• Dihydrocurcumene
• 1-Methyl-4-(6-methylheptan-2-yl)benzene
• Heptane, 2-methyl-6-p-tolyl-
• «alpha»-Curcumene, dihydro-
• 4-(1,5-Dimethylhexyl)toluene
• Dihydro-ar-curcumene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• I_np : Non-polar retention indices.
• I : 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	0.5134		Relay (1.0) Calculated Property
ΔfusH°	21.21	kJ/mol	Joback Calculated Property
ΔvapH°	69.65	kJ/mol	Relay (1.0) Calculated Property
IE	8.32	eV	Relay (1.0) Calculated Property
log10WS	-5.87		Relay (1.0) Calculated Property
logPoct/wat	4.925		Crippen Calculated Property
McVol	198.450	ml/mol	McGowan Calculated Property
Pc	1848.33	kPa	Joback Calculated Property
Inp	[243.24; 1448.00]
Inp	1448.00		NIST
Inp	250.03		NIST
Inp	247.98		NIST
Inp	245.40		NIST
Inp	243.24		NIST
I	1696.00		NIST
Tboil	538.97	K	Relay (1.0) Calculated Property
Tc	729.01	K	Relay (1.0) Calculated Property
Tfus	251.52	K	Relay (1.0) Calculated Property
Vc	0.735	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[493.68; 594.57]	J/mol×K	[573.38; 773.72]
Cp,gas	493.68	J/mol×K	573.38	Joback Calculated Property
Cp,gas	512.93	J/mol×K	606.77	Joback Calculated Property
Cp,gas	531.15	J/mol×K	640.16	Joback Calculated Property
Cp,gas	548.39	J/mol×K	673.55	Joback Calculated Property
Cp,gas	564.68	J/mol×K	706.94	Joback Calculated Property
Cp,gas	580.06	J/mol×K	740.33	Joback Calculated Property
Cp,gas	594.57	J/mol×K	773.72	Joback Calculated Property
η	[0.0001420; 0.0049185]	Pa×s	[267.75; 573.38]
η	0.0049185	Pa×s	267.75	Joback Calculated Property
η	0.0016990	Pa×s	318.69	Joback Calculated Property
η	0.0007866	Pa×s	369.63	Joback Calculated Property
η	0.0004389	Pa×s	420.56	Joback Calculated Property
η	0.0002778	Pa×s	471.50	Joback Calculated Property
η	0.0001922	Pa×s	522.44	Joback Calculated Property
η	0.0001420	Pa×s	573.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-(1,5-dimethylhexyl)-4-methyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.