Chemical Properties of Benzenepropanol, 2-methoxy- (CAS 10493-37-5)

InChI

InChI=1S/C10H14O2/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-3,5,7,11H,4,6,8H2,1H3

InChI Key

KCJSIKPCRQDRNX-UHFFFAOYSA-N

Formula

C10H14O2

SMILES

COc1ccccc1CCCO

Molecular Weight¹

166.22

CAS

10493-37-5

Other Names

• 1-Propanol, 3-(o-methoxyphenyl)-
• 3-o-Methoxyphenylpropan-1-ol
• 3-Guaiacyl propanol
• 3-(O-Methoxy phenyl)-1-propanol
• 2-Methoxyphenylpropanol

• 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.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[190.82; 450.84]	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			4.98300e+00
Coefficient B			7.86220e-01
Coefficient C			-4.03760e-04
Coefficient D			6.34000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	190.82	J/mol×K	273.00	Calculated Property
Cp,gas	235.40	J/mol×K	353.78	Calculated Property
Cp,gas	275.60	J/mol×K	434.56	Calculated Property
Cp,gas	311.60	J/mol×K	515.33	Calculated Property
Cp,gas	343.61	J/mol×K	596.11	Calculated Property
Cp,gas	371.84	J/mol×K	676.89	Calculated Property
Cp,gas	396.47	J/mol×K	757.67	Calculated Property
Cp,gas	417.71	J/mol×K	838.44	Calculated Property
Cp,gas	435.77	J/mol×K	919.22	Calculated Property
Cp,gas	450.84	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0047415; 0.0001116]	Pa×s	[324.45; 536.69]	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			-1.48317e+01
Coefficient B			3.07588e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			324.45
Temperature range, max.			536.69
η	0.0047415	Pa×s	324.45	Calculated Property
η	0.0024942	Pa×s	348.03	Calculated Property
η	0.0014235	Pa×s	371.62	Calculated Property
η	0.0008687	Pa×s	395.20	Calculated Property
η	0.0005604	Pa×s	418.78	Calculated Property
η	0.0003788	Pa×s	442.36	Calculated Property
η	0.0002664	Pa×s	465.95	Calculated Property
η	0.0001939	Pa×s	489.53	Calculated Property
η	0.0001452	Pa×s	513.11	Calculated Property
η	0.0001116	Pa×s	536.69	Calculated Property

Similar Compounds

Find more compounds similar to Benzenepropanol, 2-methoxy-.

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.