Benzene (C6H6)

Benzene presents a C6 framework, aromatic rings (formula C6H6, CAS 71-43-2). ChemicalTool Reaction can propose ranked disconnections for Benzene from the SMILES c1ccccc1.

Target: Benzene
CAS: 71-43-2
Formula: C6H6
Approx. MW: 78.11
SMILES: c1ccccc1
PubChem CID: 241
Approx. carbons: C6

Benzene structure

Properties

Molecular weight: 78.11

View on PubChem

Benzene 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Benzene?

Benzene has molecular formula C6H6. Molecular weight about 78.11 g·mol⁻¹.

What is the CAS number of Benzene?

The CAS Registry Number for Benzene is 71-43-2.

Run AI retrosynthesis for Benzene Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H6.

Related targets

Similar compounds

(3-bromophenyl)boronic Acid (3-hydroxyphenyl)boronic Acid 1-(thiophen-3-yl)ethanone 1-aminobenzotriazole 1-Bromo-2-chloro-3-fluorobenzene 1-Bromo-2-chlorobenzene

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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.