Chemical Properties of 1-(2,3-Diacetoxypropoxy)-2-(2-acetoxypropyl)benzene

InChI

InChI=1S/C18H24O7/c1-12(24-14(3)20)9-16-7-5-6-8-18(16)23-11-17(25-15(4)21)10-22-13(2)19/h5-8,12,17H,9-11H2,1-4H3

InChI Key

OUGIXDAAJGZKRM-UHFFFAOYSA-N

Formula

C18H24O7

SMILES

CC(=O)OCC(COc1ccccc1CC(C)OC(C)=O)OC(C)=O

Molecular Weight¹

352.38

Other Names

• Alprenolol desaminohydroxy + H2O, acetylated

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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).
• T_boil : Normal Boiling Point 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 Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[818.41; 879.15]	J/mol×K	[839.30; 1044.18]
Cp,gas	818.41	J/mol×K	839.30	Joback Calculated Property
Cp,gas	832.00	J/mol×K	873.45	Joback Calculated Property
Cp,gas	844.22	J/mol×K	907.59	Joback Calculated Property
Cp,gas	855.05	J/mol×K	941.74	Joback Calculated Property
Cp,gas	864.48	J/mol×K	975.89	Joback Calculated Property
Cp,gas	872.52	J/mol×K	1010.03	Joback Calculated Property
Cp,gas	879.15	J/mol×K	1044.18	Joback Calculated Property
η	[0.0000224; 0.0007010]	Pa×s	[450.78; 839.30]
η	0.0007010	Pa×s	450.78	Joback Calculated Property
η	0.0002753	Pa×s	515.53	Joback Calculated Property
η	0.0001332	Pa×s	580.29	Joback Calculated Property
η	0.0000746	Pa×s	645.04	Joback Calculated Property
η	0.0000464	Pa×s	709.79	Joback Calculated Property
η	0.0000312	Pa×s	774.55	Joback Calculated Property
η	0.0000224	Pa×s	839.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(2,3-Diacetoxypropoxy)-2-(2-acetoxypropyl)benzene.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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