Cas no 519-42-6 (4,6-dihydroxy-2,3-dimethylbenzoic acid)

4,6-Dihydroxy-2,3-dimethylbenzoic acid is a substituted benzoic acid derivative featuring hydroxyl and methyl functional groups at specific positions on the aromatic ring. This compound is of interest in organic synthesis and pharmaceutical research due to its structural features, which may influence reactivity and biological activity. The presence of hydroxyl groups enhances its potential as a chelating agent or intermediate in the preparation of more complex molecules. Its dimethyl substitution pattern contributes to steric and electronic effects, which can be leveraged in selective chemical transformations. The compound is typically characterized by its crystalline solid form and moderate solubility in polar organic solvents, making it suitable for controlled reactions.
4,6-dihydroxy-2,3-dimethylbenzoic acid structure
519-42-6 structure
Product Name:4,6-dihydroxy-2,3-dimethylbenzoic acid
CAS No:519-42-6
MF:C9H10O4
MW:182.173303127289
CID:361005
PubChem ID:71365885
Update Time:2025-10-24

4,6-dihydroxy-2,3-dimethylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 4,6-dihydroxy-2,3-dimethyl-
    • 4,6-dihydroxy-2,3-dimethylbenzoic acid
    • CHEBI:146307
    • SCHEMBL14156171
    • 2,4-dihydroxy-5,6-dimethylbenzoic acid
    • 5-Methylorsellinic acid
    • Z1262512530
    • EN300-179910
    • 519-42-6
    • DTXSID60789268
    • Inchi： 1S/C9H10O4/c1-4-5(2)8(9(12)13)7(11)3-6(4)10/h3,10-11H,1-2H3,(H,12,13)
    • InChI Key： GIBRZOCMRFRCOQ-UHFFFAOYSA-N
    • SMILES： OC1=CC(=C(C(=O)O)C(C)=C1C)O

Computed Properties

  • Exact Mass: 182.0579
  • Monoisotopic Mass: 182.05790880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 204
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 77.8?2

Experimental Properties

  • PSA: 77.76

4,6-dihydroxy-2,3-dimethylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-179910-0.05g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
0.05g
 $493.0 2023-09-19
Enamine
EN300-179910-0.1g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
0.1g
 $644.0 2023-09-19
Enamine
EN300-179910-0.25g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
0.25g
 $920.0 2023-09-19
Enamine
EN300-179910-0.5g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
0.5g
 $1449.0 2023-09-19
Enamine
EN300-179910-1.0g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
1g
 $1857.0 2023-04-26
Enamine
EN300-179910-2.5g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
2.5g
 $3641.0 2023-09-19
Enamine
EN300-179910-5.0g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
5g
 $5387.0 2023-04-26
Enamine
EN300-179910-10.0g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
10g
 $7988.0 2023-04-26
Enamine
EN300-179910-1g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
1g
 $1857.0 2023-09-19
Enamine
EN300-179910-5g
4,6-dihydroxy-2,3-dimethylbenzoic acid
 519-42-6 95%
5g
 $5387.0 2023-09-19

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