Chemical Properties of 2,3,5,6-(CH3)4-C6H-COOCH3 (CAS 22524-51-2)

2,3,5,6-(CH3)4-C6H-COOCH3

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

InChI
InChI=1S/C12H16O2/c1-7-6-8(2)10(4)11(9(7)3)12(13)14-5/h6H,1-5H3
InChI Key
GMSOGDJHFPQOBM-UHFFFAOYSA-N
Formula
C12H16O2
SMILES
COC(=O)c1c(C)c(C)cc(C)c1C
Molecular Weight1
192.25
CAS
22524-51-2
Sources

Physical Properties

Property Value Unit Source
PAff 865.20 kJ/mol NIST
BasG 834.30 kJ/mol NIST
Δf -109.87 kJ/mol Joback Calculated Property
Δfgas -345.16 kJ/mol Joback Calculated Property
Δfus 22.11 kJ/mol Joback Calculated Property
Δvap 56.39 kJ/mol Joback Calculated Property
logPoct/wat 2.71 Crippen Calculated Property
Pc 2372.59 kPa Joback Calculated Property
Tboil 596.85 K Joback Calculated Property
Tc 806.77 K Joback Calculated Property
Tfus 373.66 K Joback Calculated Property
Vc 0.62 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 392.49 J/mol×K 596.85 Joback Calculated Property
η 0.00 Pa×s 596.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 5
-CH3 5
>C=O (nonring) 1
=CH- (ring) 1

Similar Compounds

2,3-(CH3)2-C6H3-COOCH3. Benzoic acid, 2,5-dimethyl-, methyl ester. 2,6-(CH3)2-C6H3-COOCH3. Benzoic acid, 2,4,6-trimethyl-, methyl ester. 2,3,5,6-Tetramethylbenzoic acid. 2,3,6-Trimethylbenzoic acid. 1,3-Benzenedicarboxylic acid, 4-methyl-, dimethyl ester. 1,2,3-Benzenetricarboxylic acid, trimethyl ester. Benzenepentacarboxylic acid, pentamethyl ester. Benzenehexacarboxylic acid, hexamethyl ester. 1,2,3,4-Benzenetetracarboxylic acid, tetramethyl ester. 1,2,3,5-Benzenetetracarboxylic acid, tetramethyl ester. Pentamethylbenzoic acid. 1,2-Benzenedicarboxylic acid, 4-methyl-, dimethyl ester. 2,3,4,5-Tetramethylbenzoic acid.

Find more compounds similar to 2,3,5,6-(CH3)4-C6H-COOCH3.

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.