3-Methyladipic Acid (C7H12O4)
3-Methyladipic Acid presents a C7 framework, a carboxylic acid (formula C7H12O4, CAS
3058-01-3). ChemicalHelper Reaction can propose ranked disconnections for
3-Methyladipic Acid from the SMILES
CC(CCC(=O)O)CC(=O)O.
Properties
3-Methyladipic Acid 1H / 13C NMR spectrum →
FAQ
What is the chemical formula of 3-Methyladipic Acid?
3-Methyladipic Acid has molecular formula C7H12O4. Molecular weight about 160.17 g·mol⁻¹.
What is the CAS number of 3-Methyladipic Acid?
The CAS Registry Number for 3-Methyladipic Acid is 3058-01-3.
Open the planner with 3-Methyladipic Acid preloaded, then keep routes that match CAS 3058-01-3.
Related targets
Similar compounds
pimelic acid(S)-2-Amino-6-guanidinohexanoic acid1-Aminocyclohexanecarboxylic acid1-Glycylproline2-Amino-6-ureidohexanoic acid2-Isopropylmalic acid
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References & tools
- ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
- PubChem — compound identifiers and structure depictions (NIH/NCBI).
- Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.