Chemical Properties of Propionic acid, 3-(benzyloxy)-2-bromo-, ethyl ester (CAS 39897-10-4)

InChI

InChI=1S/C12H15BrO3/c1-2-16-12(14)11(13)9-15-8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3

InChI Key

FPEMNHDCFKTXBC-UHFFFAOYSA-N

Formula

C12H15BrO3

SMILES

CCOC(=O)C(Br)COCc1ccccc1

Molecular Weight¹

287.15

CAS

39897-10-4

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[460.48; 530.67]	J/mol×K	[665.07; 884.72]
Cp,gas	460.48	J/mol×K	665.07	Joback Calculated Property
Cp,gas	474.40	J/mol×K	701.68	Joback Calculated Property
Cp,gas	487.41	J/mol×K	738.29	Joback Calculated Property
Cp,gas	499.51	J/mol×K	774.89	Joback Calculated Property
Cp,gas	510.75	J/mol×K	811.50	Joback Calculated Property
Cp,gas	521.12	J/mol×K	848.11	Joback Calculated Property
Cp,gas	530.67	J/mol×K	884.72	Joback Calculated Property
η	[0.0001246; 0.0013953]	Pa×s	[390.61; 665.07]
η	0.0013953	Pa×s	390.61	Joback Calculated Property
η	0.0007553	Pa×s	436.35	Joback Calculated Property
η	0.0004594	Pa×s	482.10	Joback Calculated Property
η	0.0003045	Pa×s	527.84	Joback Calculated Property
η	0.0002156	Pa×s	573.58	Joback Calculated Property
η	0.0001606	Pa×s	619.33	Joback Calculated Property
η	0.0001246	Pa×s	665.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propionic acid, 3-(benzyloxy)-2-bromo-, ethyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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