3-Methyl-1-butanethiol (C5H12S)
3-Methyl-1-butanethiol (C5H12S; CAS 541-31-1) is a practical retrosynthesis target. 3-Methyl-1-butanethiol presents a C5 framework. Open AI route search in one click below.
Properties
3-Methyl-1-butanethiol 1H / 13C NMR spectrum →
FAQ
What is the chemical formula of 3-Methyl-1-butanethiol?
3-Methyl-1-butanethiol has molecular formula C5H12S. Molecular weight about 104.21 g·mol⁻¹.
What is the CAS number of 3-Methyl-1-butanethiol?
The CAS Registry Number for 3-Methyl-1-butanethiol is 541-31-1.
Start from this SMILES and explore AI retrosynthesis routes for C5H12S.
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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.