Chemical Properties of Sebacic acid, ethyl 2-(3-nitrophenyl)ethyl ester

Sebacic acid, ethyl 2-(3-nitrophenyl)ethyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C20H29NO6/c1-2-26-19(22)12-7-5-3-4-6-8-13-20(23)27-15-14-17-10-9-11-18(16-17)21(24)25/h9-11,16H,2-8,12-15H2,1H3
InChI Key
QPNWEVHCYGIAHG-UHFFFAOYSA-N
Formula
C20H29NO6
SMILES
CCOC(=O)CCCCCCCCC(=O)OCCc1cccc([N+](=O)[O-])c1
Molecular Weight1
379.45
Sources

Physical Properties

Property Value Unit Source
Δf -211.99 kJ/mol Joback Calculated Property
Δfgas -731.43 kJ/mol Joback Calculated Property
Δfus 58.14 kJ/mol Joback Calculated Property
Δvap 97.96 kJ/mol Joback Calculated Property
logPoct/wat 4.364 Crippen Calculated Property
Pc 1353.63 kPa Joback Calculated Property
Tboil 993.08 K Joback Calculated Property
Tc 1218.94 K Joback Calculated Property
Tfus 642.03 K Joback Calculated Property
Vc 1.177 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 988.43 J/mol×K 993.08 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
-NO2 1
=C< (ring) 2
-CH2- 11
-CH3 1

Similar Compounds

Sebacic acid, 2-(3-nitrophenyl)ethyl propyl ester. Sebacic acid, butyl 2-(3-nitrophenyl)ethyl ester. Sebacic acid, 2-(3-nitrophenyl)ethyl pentyl ester. Sebacic acid, hexyl 2-(3-nitrophenyl)ethyl ester. Sebacic acid, isobutyl 2-(3-nitrophenyl)ethyl ester. Glutaric acid, ethyl 3-nitrophenethyl ester. Glutaric acid, 3-nitrophenethyl nonyl ester. Glutaric acid, 3-nitrophenethyl undecyl ester. Glutaric acid, dodecyl 3-nitrophenethyl ester. Glutaric acid, 3-nitrophenethyl tridecyl ester. Glutaric acid, decyl 3-nitrophenethyl ester. Glutaric acid, heptyl 3-nitrophenethyl ester. Glutaric acid, 3-nitrophenethyl octyl ester. Glutaric acid, 3-nitrophenethyl propyl ester. Glutaric acid, hexyl 3-nitrophenethyl ester.

Find more compounds similar to Sebacic acid, ethyl 2-(3-nitrophenyl)ethyl ester.

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.