CBr4

Carbon tetrabromide · Tetrabromomethane

Carbon tetrabromide is a stable, semiconducting organic halide widely utilized as a reagent in chemical synthesis and as a flame retardant.

BrC
Crystal structure of CBr4
Ground-state structure · Materials Project
Overview

About Carbon tetrabromide

Carbon tetrabromide is a halogenated organic compound that sits on the thermodynamic convex hull, indicating robust stability under standard conditions. As a semiconducting material, it serves as a critical reagent in various organic transformations, particularly in Appel reactions and bromination processes.

Beyond its utility in synthesis, the compound is valued for its physical properties in specialized industrial applications. Its structural characteristics have been extensively documented across multiple databases, reflecting its importance as a fundamental building block in halogen chemistry.

At a glance

Key Properties

Cross-validated computational properties for Carbon tetrabromide, aggregated across 4 databases.

Band Gap

2.93 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
4 databases, 7 space groups
Uses

Applications

Where Carbon tetrabromide is used.

Organic synthesisAppel reaction reagentFlame retardant additiveBrominating agent
Reference

Frequently Asked Questions

Common questions about Carbon tetrabromide, answered from cross-validated data.

What is CBr4?

Carbon tetrabromide is a stable, semiconducting organic halide widely utilized as a reagent in chemical synthesis and as a flame retardant.

More questions
What is CBr4 used for?
Carbon tetrabromide (CBr4) is used in organic synthesis, appel reaction reagent, flame retardant additive, and brominating agent.
What is the band gap of CBr4?
Carbon tetrabromide (CBr4) has a DFT-computed band gap of 2.93 eV across 10 reported structures.
Is CBr4 a metal, semiconductor, or insulator?
With a band gap up to 2.93 eV it is a semiconductor.
Is CBr4 thermodynamically stable?
Yes — Carbon tetrabromide (CBr4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of CBr4 are known?
10 structures of CBr4 are reported across 4 databases, spanning 7 distinct space groups.
What elements does CBr4 contain?
Carbon tetrabromide (CBr4) contains Br and C (2 elements).
Where does the data for CBr4 come from?
CBr4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a primary halogenated carbon derivative, carbon tetrabromide serves as a benchmark for reactivity and stability within the broader class of polyhalogenated alkanes, providing a versatile platform for electrophilic bromination that is essential in synthetic organic chemistry.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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