Chemical Properties of Isophthalic acid, monoamide, N-(2-ethylhexyl)-, heptyl ester

Isophthalic acid, monoamide, N-(2-ethylhexyl)-, heptyl ester

InChI
InChI=1S/C23H37NO3/c1-4-7-9-10-11-16-27-23(26)21-15-12-14-20(17-21)22(25)24-18-19(6-3)13-8-5-2/h12,14-15,17,19H,4-11,13,16,18H2,1-3H3,(H,24,25)
InChI Key
AQJOVJGOVMSIKT-UHFFFAOYSA-N
Formula
C23H37NO3
SMILES
CCCCCCCOC(=O)c1cccc(C(O)=NCC(CC)CCCC)c1
Molecular Weight1
375.54
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
ω 1.1852 Relay (1.0) Calculated Property
log10WS -6.23 Relay (1.0) Calculated Property
logPoct/wat 6.335 Crippen Calculated Property
McVol 330.160 ml/mol McGowan Calculated Property
Pc 1037.23 kPa Joback Calculated Property
Inp [3018.00; 3018.00]   Show Hide
Inp 3018.00 NIST
Inp 3018.00 NIST
Tboil 680.87 K Relay (1.0) Calculated Property
Tc 899.77 K Relay (1.0) Calculated Property
Tfus 323.22 K Relay (1.0) Calculated Property
Vc 1.200 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, 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.

Similar Compounds

Isophthalic acid, monoamide, N-(2-ethylhexyl)-, pentyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, hexyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, isohexyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, butyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, propyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, isobutyl ester. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, ethyl ester. Isophthalic acid, monoamide, N-butyl-, isohexyl ester. Isophthalic acid, monoamide, N-butyl-, hexyl ester. N-2-(1-benzoxy) pentylbenzamide. 13«alpha»-Benzoyloxylupanine. Aconitine. 13-Benzoyloxy-17-oxolupanine. 13-Cinnamoyloxymultiflorine. Isophthalic acid, monoamide, N-(2-ethylhexyl)-, octyl ester.

Find more compounds similar to Isophthalic acid, monoamide, N-(2-ethylhexyl)-, heptyl 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.