Chemical Properties of Propyl gallate (CAS 121-79-9)

InChI

InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3

InChI Key

ZTHYODDOHIVTJV-UHFFFAOYSA-N

Formula

C10H12O5

SMILES

CCCOC(=O)c1cc(O)c(O)c(O)c1

Molecular Weight¹

212.20

CAS

121-79-9

Other Names

• 3,4,5-Trihydroxybenzene-1-propylcarboxylate
• 3,4,5-Trihydroxybenzoic acid n-propyl ester
• 3,4,5-Trihydroxybenzoic acid, propyl ester
• Benzoic acid, 3,4,5-trihydroxy-, propyl ester
• Gallic acid n-propyl ester
• Gallic acid, propyl ester
• NCI-C505888
• NSC 2626
• Nipa 49
• Nipagallin P
• PG
• Progallin P
• Propyl 3,4,5-trihydroxybenzoate
• Propylester kyseliny gallove
• Tenox PG
• n-Propyl 3,4,5-trihydroxybenzoate
• n-Propyl ester of 3,4,5-trihydroxybenzoic acid
• n-Propyl gallate

• 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	[435.32; 494.81]	J/mol×K	[773.03; 1012.07]
Cp,gas	435.32	J/mol×K	773.03	Joback Calculated Property
Cp,gas	445.02	J/mol×K	812.87	Joback Calculated Property
Cp,gas	454.57	J/mol×K	852.71	Joback Calculated Property
Cp,gas	464.15	J/mol×K	892.55	Joback Calculated Property
Cp,gas	473.93	J/mol×K	932.39	Joback Calculated Property
Cp,gas	484.09	J/mol×K	972.23	Joback Calculated Property
Cp,gas	494.81	J/mol×K	1012.07	Joback Calculated Property
η	[6.7950144e-08; 0.0000009]	Pa×s	[636.20; 773.03]
η	0.0000009	Pa×s	636.20	Joback Calculated Property
η	0.0000005	Pa×s	659.00	Joback Calculated Property
η	0.0000003	Pa×s	681.81	Joback Calculated Property
η	0.0000002	Pa×s	704.62	Joback Calculated Property
η	0.0000001	Pa×s	727.42	Joback Calculated Property
η	9.7536895e-08	Pa×s	750.23	Joback Calculated Property
η	6.7950144e-08	Pa×s	773.03	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propyl gallate.

Mixtures

• Propyl gallate + Water

Sources

• Crippen Method
• Solubilities of Gallic Acid and Its Esters in Water
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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