Chemical Properties of Diglycolic acid, 2-formylphenyl isohexyl ester

Diglycolic acid, 2-formylphenyl isohexyl ester

InChI
InChI=1S/C17H22O6/c1-13(2)6-5-9-22-16(19)11-21-12-17(20)23-15-8-4-3-7-14(15)10-18/h3-4,7-8,10,13H,5-6,9,11-12H2,1-2H3
InChI Key
OWUABLIVYLSIPM-UHFFFAOYSA-N
Formula
C17H22O6
SMILES
CC(C)CCCOC(=O)COCC(=O)Oc1ccccc1C=O
Molecular Weight1
322.35
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 42.13 kJ/mol Joback Calculated Property
log10WS -3.23 Relay (1.0) Calculated Property
logPoct/wat 2.400 Crippen Calculated Property
McVol 248.950 ml/mol McGowan Calculated Property
Inp [2917.00; 2917.00]   Show Hide
Inp 2917.00 NIST
Inp 2917.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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 [738.55; 802.97] J/mol×K [807.30; 1009.61] Show Hide
Cp,gas 738.55 J/mol×K 807.30 Joback Calculated Property
Cp,gas 752.17 J/mol×K 841.02 Joback Calculated Property
Cp,gas 764.63 J/mol×K 874.74 Joback Calculated Property
Cp,gas 775.94 J/mol×K 908.45 Joback Calculated Property
Cp,gas 786.10 J/mol×K 942.17 Joback Calculated Property
Cp,gas 795.10 J/mol×K 975.89 Joback Calculated Property
Cp,gas 802.97 J/mol×K 1009.61 Joback Calculated Property
η [0.0000482; 0.0008882] Pa×s [454.18; 807.30] Show Hide
η 0.0008882 Pa×s 454.18 Joback Calculated Property
η 0.0004137 Pa×s 513.03 Joback Calculated Property
η 0.0002255 Pa×s 571.89 Joback Calculated Property
η 0.0001376 Pa×s 630.74 Joback Calculated Property
η 0.0000914 Pa×s 689.59 Joback Calculated Property
η 0.0000647 Pa×s 748.45 Joback Calculated Property
η 0.0000482 Pa×s 807.30 Joback Calculated Property

Similar Compounds

Diglycolic acid, 2-formylphenyl hexyl ester. Diglycolic acid, 2-formylphenyl pentyl ester. Diglycolic acid, 2-formylphenyl heptyl ester. Diglycolic acid, butyl 2-formylphenyl ester. Diglycolic acid, isohexyl 2-methylphenyl ester. Diglycolic acid, 2-acetylphenyl isohexyl ester. Diglycolic acid, 2,5-dimethylphenyl isohexyl ester. Diglycolic acid, 4-chloro-2-methylphenyl isohexyl ester. Diglycolic acid, 2-acetylphenyl hexyl ester. Diglycolic acid, 2-acetylphenyl pentyl ester. Diglycolic acid, 2-formylphenyl isobutyl ester. Diglycolic acid, 2-acetylphenyl octyl ester. Diglycolic acid, 2-acetylphenyl undecyl ester. Diglycolic acid, 2-acetylphenyl heptyl ester. Diglycolic acid, 2-acetylphenyl nonyl ester.

Find more compounds similar to Diglycolic acid, 2-formylphenyl isohexyl ester.

Sources

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.
These property values are available through the Cheméo API. A free account gives you an access key.