Pentamethylene chloride (C5H10Cl2)

Pentamethylene chloride presents a C5 framework, halogen substitution (formula C5H10Cl2, CAS 628-76-2). ChemicalTool Reaction can propose ranked disconnections for Pentamethylene chloride from the SMILES ClCCCCCCl.

Target: Pentamethylene chloride
CAS: 628-76-2
Formula: C5H10Cl2
Approx. MW: 141.04
SMILES: ClCCCCCCl
PubChem CID: 12353
Approx. carbons: C5

Pentamethylene chloride structure

Properties

Molecular weight: 141.04

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Pentamethylene chloride 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Pentamethylene chloride?

Pentamethylene chloride has molecular formula C5H10Cl2. Molecular weight about 141.04 g·mol⁻¹.

What is the CAS number of Pentamethylene chloride?

The CAS Registry Number for Pentamethylene chloride is 628-76-2.

Run AI retrosynthesis for Pentamethylene chloride Target catalog AI tools overview

One click loads Pentamethylene chloride into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

(RS)-2-Methylbutyryl chloride 1-Bromo-3-Methylbutane 1-Bromo-5-chloropentane 1-Bromopentane 1-Chloro-3-Methylbutane 1-Chloropent-2-yne

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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.