Thioctic acid (C8H14O2S2)

thioctic acid (C8H14O2S2; CAS 1077-28-7) is a practical retrosynthesis target. thioctic acid presents a C8 framework, a carboxylic acid. Open AI route search in one click below.

Target: Thioctic acid
CAS: 1077-28-7
Formula: C8H14O2S2
Approx. MW: 206.32
SMILES: O=C(O)CCCCC1CCSS1
PubChem CID: 864
Approx. carbons: C8

Thioctic acid structure

Properties

Molecular weight: 206.32

View on PubChem

Thioctic acid 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Thioctic acid?

Thioctic acid has molecular formula C8H14O2S2. Molecular weight about 206.32 g·mol⁻¹.

What is the CAS number of Thioctic acid?

The CAS Registry Number for Thioctic acid is 1077-28-7.

Run AI retrosynthesis for Thioctic acid Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C8H14O2S2.

Related targets

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2-Aminooctanoic acid 2-Hydroxyoctanoic acid 6-acetamido-2-aminohexanoic acid 7-aminodesacetoxycephalosporanic acid Butanetetracarboxylic acid Cycloheptanecarboxylic Acid

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.