Allyl bromide (C3H5Br)

Looking for routes to Allyl Bromide? Allyl Bromide presents a C3 framework, halogen substitution, unsaturation. Use the planner with prefilled SMILES, or copy C=CCBr (CAS 106-95-6).

Target: Allyl bromide
CAS: 106-95-6
Formula: C3H5Br
Approx. MW: 120.98
SMILES: C=CCBr
PubChem CID: 7841
Approx. carbons: C3

Allyl bromide structure

Properties

IUPAC name: 3-bromoprop-1-ene
Molecular weight: 120.98
Exact mass: 119.96
InChIKey: BHELZAPQIKSEDF-UHFFFAOYSA-N
Melting point: -182 °F (USCG, 1999)
Boiling point: 158 °F at 760 mmHg (USCG, 1999)
Density: 1.4161 at 68 °F (USCG, 1999) - Denser than water; will sink

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Allyl bromide 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Allyl bromide?

Allyl bromide has molecular formula C3H5Br. Molecular weight about 120.98 g·mol⁻¹.

What is the CAS number of Allyl bromide?

The CAS Registry Number for Allyl bromide is 106-95-6.

Run AI retrosynthesis for Allyl bromide Target catalog AI tools overview

Open the planner with Allyl bromide preloaded, then keep routes that match CAS 106-95-6.

Related targets

Similar compounds

2-Bromopropene Bromocyclopropane 1-iodoprop-1-yne 2-Bromoallyl bromide Allyl Iodide Propargyl Bromide

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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.