Chemical Properties of 4-Methoxybenzoic acid, 8-chlorooctyl ester

4-Methoxybenzoic acid, 8-chlorooctyl ester

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

InChI
InChI=1S/C16H23ClO3/c1-19-15-10-8-14(9-11-15)16(18)20-13-7-5-3-2-4-6-12-17/h8-11H,2-7,12-13H2,1H3
InChI Key
NBGBVTBBAOFRQV-UHFFFAOYSA-N
Formula
C16H23ClO3
SMILES
COc1ccc(C(=O)OCCCCCCCCCl)cc1
Molecular Weight1
298.80
Sources

Physical Properties

Property Value Unit Source
Δf -164.23 kJ/mol Joback Calculated Property
Δfgas -541.27 kJ/mol Joback Calculated Property
Δfus 39.02 kJ/mol Joback Calculated Property
Δvap 70.10 kJ/mol Joback Calculated Property
logPoct/wat 4.43 Crippen Calculated Property
Pc 1671.43 kPa Joback Calculated Property
Tboil 733.28 K Joback Calculated Property
Tc 932.17 K Joback Calculated Property
Tfus 433.33 K Joback Calculated Property
Vc 0.91 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 657.83 J/mol×K 733.28 Joback Calculated Property
η 0.00 Pa×s 733.28 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-Cl 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 8
>C=O (nonring) 1
-CH3 1

Similar Compounds

Benzoic acid, 4-methoxy-, undecyl ester. P-methoxybenzoic acid, octadecyl ester. Benzoic acid, 4-methoxy-, pentadecyl ester. p-Methoxybenzoic acid, hexadecyl ester. p-Methoxybenzoic acid, octyl ester. p-Methoxybenzoic acid, tetradecyl ester. Benzoic acid, 4-methoxy-, nonyl ester. P-methoxybenzoic acid, tridecyl ester. Benzoic acid, 4-methoxy-, decyl ester. P-anisic acid, heptadecyl ester. Benzoic acid, 4-methoxy-, heptyl ester. p-Methoxybenzoic acid, hexyl ester. Amyl anisate. Benzoic acid, 4-methoxy-, butyl ester. Octyl p-butoxybenzoate.

Find more compounds similar to 4-Methoxybenzoic acid, 8-chlorooctyl 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.