Chemical Properties of 2-Phenylpropyl butyrate (CAS 80866-83-7)

InChI

InChI=1S/C13H18O2/c1-3-7-13(14)15-10-11(2)12-8-5-4-6-9-12/h4-6,8-9,11H,3,7,10H2,1-2H3

InChI Key

SKLXPNZDCBPHCS-UHFFFAOYSA-N

Formula

C13H18O2

SMILES

CCCC(=O)OCC(C)c1ccccc1

Molecular Weight¹

206.28

CAS

80866-83-7

Other Names

• Butanoic acid, 2-phenylpropyl ester

• 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).
• 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).
• 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	[443.71; 527.37]	J/mol×K	[599.37; 806.35]
Cp,gas	443.71	J/mol×K	599.37	Joback Calculated Property
Cp,gas	459.89	J/mol×K	633.87	Joback Calculated Property
Cp,gas	475.13	J/mol×K	668.36	Joback Calculated Property
Cp,gas	489.48	J/mol×K	702.86	Joback Calculated Property
Cp,gas	502.95	J/mol×K	737.36	Joback Calculated Property
Cp,gas	515.57	J/mol×K	771.85	Joback Calculated Property
Cp,gas	527.37	J/mol×K	806.35	Joback Calculated Property
η	[0.0001567; 0.0027865]	Pa×s	[319.85; 599.37]
η	0.0027865	Pa×s	319.85	Joback Calculated Property
η	0.0012714	Pa×s	366.44	Joback Calculated Property
η	0.0006925	Pa×s	413.02	Joback Calculated Property
η	0.0004266	Pa×s	459.61	Joback Calculated Property
η	0.0002873	Pa×s	506.20	Joback Calculated Property
η	0.0002068	Pa×s	552.78	Joback Calculated Property
η	0.0001567	Pa×s	599.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Phenylpropyl butyrate.

Sources

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

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