Chemical Properties of 2,5-DIMETHYLBENZYL ALCOHOL

InChI

InChI=1S/C9H12O/c1-7-3-4-8(2)9(5-7)6-10/h3-5,10H,6H2,1-2H3

InChI Key

LEBQTCCCNMTXSF-UHFFFAOYSA-N

Formula

C9H12O

SMILES

Cc1ccc(C)c(CO)c1

Molecular Weight¹

136.19

Other Names

• Benzenemethanol, 2,5-dimethyl-

• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[156.75; 377.71]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-5.30900e+00
Coefficient B			6.94940e-01
Coefficient C			-3.93320e-04
Coefficient D			8.14000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	156.75	J/mol×K	273.00	Calculated Property
Cp,gas	194.92	J/mol×K	353.78	Calculated Property
Cp,gas	229.09	J/mol×K	434.56	Calculated Property
Cp,gas	259.50	J/mol×K	515.33	Calculated Property
Cp,gas	286.43	J/mol×K	596.11	Calculated Property
Cp,gas	310.12	J/mol×K	676.89	Calculated Property
Cp,gas	330.84	J/mol×K	757.67	Calculated Property
Cp,gas	348.84	J/mol×K	838.44	Calculated Property
Cp,gas	364.38	J/mol×K	919.22	Calculated Property
Cp,gas	377.71	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0044612; 0.0001409]	Pa×s	[314.15; 512.04]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.43519e+01
Coefficient B			2.80837e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			314.15
Temperature range, max.			512.04
η	0.0044612	Pa×s	314.15	Calculated Property
η	0.0024860	Pa×s	336.14	Calculated Property
η	0.0014884	Pa×s	358.13	Calculated Property
η	0.0009456	Pa×s	380.11	Calculated Property
η	0.0006313	Pa×s	402.10	Calculated Property
η	0.0004395	Pa×s	424.09	Calculated Property
η	0.0003171	Pa×s	446.08	Calculated Property
η	0.0002359	Pa×s	468.06	Calculated Property
η	0.0001803	Pa×s	490.05	Calculated Property
η	0.0001409	Pa×s	512.04	Calculated Property

Similar Compounds

Find more compounds similar to 2,5-DIMETHYLBENZYL ALCOHOL.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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