Chemical Properties of Benzaldehyde, 3-(phenylmethoxy)- (CAS 1700-37-4)

InChI

InChI=1S/C14H12O2/c15-10-13-7-4-8-14(9-13)16-11-12-5-2-1-3-6-12/h1-10H,11H2

InChI Key

JAICGBJIBWDEIZ-UHFFFAOYSA-N

Formula

C14H12O2

SMILES

O=Cc1cccc(OCc2ccccc2)c1

Molecular Weight¹

212.24

CAS

1700-37-4

Other Names

• Benzaldehyde, m-(benzyloxy)-
• m-Benzyloxybenzaldehyde
• 3-Benzyloxybenzaldehyde
• Benzyl 3-formylphenyl ether

• 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).
• 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, Enthalpy of vaporization at standard conditions 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	[210.83; 510.79]	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			-2.64490e+01
Coefficient B			1.02780e+00
Coefficient C			-6.15160e-04
Coefficient D			1.24600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	210.83	J/mol×K	273.00	Calculated Property
Cp,gas	265.69	J/mol×K	353.78	Calculated Property
Cp,gas	314.25	J/mol×K	434.56	Calculated Property
Cp,gas	356.90	J/mol×K	515.33	Calculated Property
Cp,gas	394.03	J/mol×K	596.11	Calculated Property
Cp,gas	426.05	J/mol×K	676.89	Calculated Property
Cp,gas	453.34	J/mol×K	757.67	Calculated Property
Cp,gas	476.29	J/mol×K	838.44	Calculated Property
Cp,gas	495.31	J/mol×K	919.22	Calculated Property
Cp,gas	510.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014593; 0.0001893]	Pa×s	[377.13; 621.44]	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			-1.17242e+01
Coefficient B			1.95898e+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.			377.13
Temperature range, max.			621.44
η	0.0014593	Pa×s	377.13	Calculated Property
η	0.0010296	Pa×s	404.28	Calculated Property
η	0.0007590	Pa×s	431.42	Calculated Property
η	0.0005801	Pa×s	458.57	Calculated Property
η	0.0004569	Pa×s	485.71	Calculated Property
η	0.0003691	Pa×s	512.86	Calculated Property
η	0.0003046	Pa×s	540.00	Calculated Property
η	0.0002560	Pa×s	567.15	Calculated Property
η	0.0002187	Pa×s	594.30	Calculated Property
η	0.0001893	Pa×s	621.44	Calculated Property

Similar Compounds

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

Sources

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

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