Pentane (C5H12)
Looking for routes to Pentane?
Pentane presents a C5 framework. Use the planner with prefilled SMILES, or copy
CCCCC
(CAS 109-66-0).
Properties
Pentane 1H / 13C NMR spectrum →
FAQ
What is the chemical formula of Pentane?
Pentane has molecular formula C5H12. Molecular weight about 72.15 g·mol⁻¹.
What is the CAS number of Pentane?
The CAS Registry Number for Pentane is 109-66-0.
Start from this SMILES and explore AI retrosynthesis routes for C5H12.
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.