Chemical Properties of 1-Propanol, 3-(phenylmethoxy)-

InChI

InChI=1S/C10H14O2/c11-7-4-8-12-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2

InChI Key

FUCYABRIJPUVAT-UHFFFAOYSA-N

Formula

C10H14O2

SMILES

OCCCOCc1ccccc1

Molecular Weight¹

166.22

Other Names

• 1-Propanol, 3-(benzyloxy)-
• 1,3-Propanediol monobenzyl ether
• 3-Benzyloxypropan-1-ol
• 3-Benzyloxypropanol
• Trimethylene glycol monobenzyl ether
• 3-benzyloxy-1-propanol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, 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	[188.27; 453.88]	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			-9.31600e+00
Coefficient B			8.45700e-01
Coefficient C			-4.70800e-04
Coefficient D			8.83000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	188.27	J/mol×K	273.00	Calculated Property
Cp,gas	234.86	J/mol×K	353.78	Calculated Property
Cp,gas	276.53	J/mol×K	434.56	Calculated Property
Cp,gas	313.56	J/mol×K	515.33	Calculated Property
Cp,gas	346.22	J/mol×K	596.11	Calculated Property
Cp,gas	374.80	J/mol×K	676.89	Calculated Property
Cp,gas	399.58	J/mol×K	757.67	Calculated Property
Cp,gas	420.83	J/mol×K	838.44	Calculated Property
Cp,gas	438.84	J/mol×K	919.22	Calculated Property
Cp,gas	453.88	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0074425; 0.0001170]	Pa×s	[311.93; 532.52]	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			-1.49257e+01
Coefficient B			3.12714e+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.			311.93
Temperature range, max.			532.52
η	0.0074425	Pa×s	311.93	Calculated Property
η	0.0035853	Pa×s	336.44	Calculated Property
η	0.0019073	Pa×s	360.95	Calculated Property
η	0.0010994	Pa×s	385.46	Calculated Property
η	0.0006769	Pa×s	409.97	Calculated Property
η	0.0004402	Pa×s	434.48	Calculated Property
η	0.0002997	Pa×s	458.99	Calculated Property
η	0.0002122	Pa×s	483.50	Calculated Property
η	0.0001553	Pa×s	508.01	Calculated Property
η	0.0001170	Pa×s	532.52	Calculated Property

Similar Compounds

Find more compounds similar to 1-Propanol, 3-(phenylmethoxy)-.

Sources

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

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