(RS)-2-Methylbutyryl chloride (C5H9ClO)

Looking for routes to (RS)-2-Methylbutyryl chloride? (RS)-2-Methylbutyryl chloride presents a C5 framework, halogen substitution. Use the planner with prefilled SMILES, or copy CCC(C)C(=O)Cl (CAS 57526-28-0).

Target: (RS)-2-Methylbutyryl chloride
CAS: 57526-28-0
Formula: C5H9ClO
Approx. MW: 120.58
SMILES: CCC(C)C(=O)Cl
PubChem CID: 93697
Approx. carbons: C5

(RS)-2-Methylbutyryl chloride structure

Properties

IUPAC name: 2-methylbutanoyl chloride
Molecular weight: 120.58
Exact mass: 120.03
InChIKey: XRPVXVRWIDOORM-UHFFFAOYSA-N

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(RS)-2-Methylbutyryl chloride 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of (RS)-2-Methylbutyryl chloride?

(RS)-2-Methylbutyryl chloride has molecular formula C5H9ClO. Molecular weight about 120.58 g·mol⁻¹.

What is the CAS number of (RS)-2-Methylbutyryl chloride?

The CAS Registry Number for (RS)-2-Methylbutyryl chloride is 57526-28-0.

Run AI retrosynthesis for (RS)-2-Methylbutyryl chloride Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C5H9ClO.

Related targets

Similar compounds

5-Chloro-2-pentanone Isovaleryl chloride Tetrahydrofurfuryl chloride Valeryl chloride 1-Bromo-3-Methylbutane 1-Bromo-5-chloropentane

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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.