Chemical Properties of 2,3,6-Trimethylbenzoic acid (CAS 2529-36-4)

2,3,6-Trimethylbenzoic acid

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InChI
InChI=1S/C10H12O2/c1-6-4-5-7(2)9(8(6)3)10(11)12/h4-5H,1-3H3,(H,11,12)
InChI Key
JRUKSSBDIZXQDX-UHFFFAOYSA-N
Formula
C10H12O2
SMILES
Cc1ccc(C)c(C([O])=O)c1C
Molecular Weight1
164.20
CAS
2529-36-4
Sources

Physical Properties

Property Value Unit Source
Δcsolid -5174.52 ± 0.84 kJ/mol NIST
Δfgas -371.20 ± 1.90 kJ/mol NIST
Δfsolid -475.60 ± 1.90 kJ/mol NIST
Δsub 104.40 ± 0.20 kJ/mol NIST
Δsub 104.40 kJ/mol NIST
Δsub 104.40 ± 0.20 kJ/mol NIST
logPoct/wat 2.18 Crippen Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 103.60 ± 0.20 kJ/mol 325.0 NIST

Similar Compounds

2,3,5,6-Tetramethylbenzoic acid. Pentamethylbenzoic acid. 2,3,4,5-Tetramethylbenzoic acid. Benzoic acid, 2,3-dimethyl-. Benzoic acid, 2,5-dimethyl-. Benzoic acid, 2,4,5-trimethyl-. 2,3,5,6-(CH3)4-C6H-COOCH3. Benzoic acid, 2,6-dimethyl-. Benzoic acid, 2,4,6-trimethyl-. 1,2,3-Benzenetricarboxylic acid. Benzenepentacarboxylic acid. BENZENEHEXACARBOXYLIC ACID. 1,2-Benzenedicarboxylic acid, 4-methyl-. 2,3-(CH3)2-C6H3-COOCH3. Benzoic acid, 2,5-dimethyl-, methyl ester.

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