5-(4-Chlorobutyl)hydantoin (C7H11ClN2O2)

5-(4-Chlorobutyl)hydantoin (C7H11ClN2O2; CAS 40126-55-4) is a practical retrosynthesis target. 5-(4-Chlorobutyl)hydantoin presents a C7 framework, basic nitrogen, halogen substitution. Open AI route search in one click below.

Target: 5-(4-Chlorobutyl)hydantoin
CAS: 40126-55-4
Formula: C7H11ClN2O2
Approx. MW: 190.63
SMILES: O=C1NC(=O)C(CCCCCl)N1
PubChem CID: 229807
Approx. carbons: C7

5-(4-Chlorobutyl)hydantoin structure

Properties

Molecular weight: 190.63

View on PubChem

5-(4-Chlorobutyl)hydantoin 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 5-(4-Chlorobutyl)hydantoin?

5-(4-Chlorobutyl)hydantoin has molecular formula C7H11ClN2O2. Molecular weight about 190.63 g·mol⁻¹.

What is the CAS number of 5-(4-Chlorobutyl)hydantoin?

The CAS Registry Number for 5-(4-Chlorobutyl)hydantoin is 40126-55-4.

Run AI retrosynthesis for 5-(4-Chlorobutyl)hydantoin Target catalog AI tools overview

Open the planner with 5-(4-Chlorobutyl)hydantoin preloaded, then keep routes that match CAS 40126-55-4.

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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.