1-Chloro-3-Methylbutane (C5H11Cl)

1-Chloro-3-Methylbutane presents a C5 framework, halogen substitution (formula C5H11Cl, CAS 107-84-6). ChemicalTool Reaction can propose ranked disconnections for 1-Chloro-3-Methylbutane from the SMILES CC(C)CCCl.

Target: 1-Chloro-3-Methylbutane
CAS: 107-84-6
Formula: C5H11Cl
Approx. MW: 106.59
SMILES: CC(C)CCCl
PubChem CID: 7893
Approx. carbons: C5

1-Chloro-3-Methylbutane structure

Properties

IUPAC name: 1-chloro-3-methylbutane
Common names: 1-CHLORO-3-METHYLBUTANE; Isoamyl chloride; Isopentyl chloride; 3-Methylbutyl chloride; Butane, 1-chloro-3-methyl-; 4-Chloro-2-methylbutane; 1-Chloro-3,3-dimethylpropane; UNII-87D3ZL9F7A; 87D3ZL9F7A; NSC-6528
Molecular weight: 106.59
Exact mass: 106.05
InChIKey: CZHLPWNZCJEPJB-UHFFFAOYSA-N

View on PubChem

1-Chloro-3-Methylbutane 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 1-Chloro-3-Methylbutane?

1-Chloro-3-Methylbutane has molecular formula C5H11Cl. Molecular weight about 106.59 g·mol⁻¹.

What is the CAS number of 1-Chloro-3-Methylbutane?

The CAS Registry Number for 1-Chloro-3-Methylbutane is 107-84-6.

Run AI retrosynthesis for 1-Chloro-3-Methylbutane Target catalog AI tools overview

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Related targets

Similar compounds

1-Chloropentane 2-Chloro-2-methylbutane (RS)-2-Methylbutyryl chloride 1-Bromo-3-Methylbutane 1-Bromo-5-chloropentane 1-Bromopentane

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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.