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Bromobenzene chemical structure, C6H5Br, CAS 108-86-1
2D chemical structure

Key facts

What buyers check first

Appearance
Mobile liquid
Melting point
-30.6 °C
Boiling point
156.2 °C
Density
Relative density (water = 1): 1.5
Flash point
51 °C
HS code
290399
Category
Impurities and reference standards
UN number
UN 2514
Illustrative photo, a closed 1000 litre IBC tote in a warehouse
Typical packagingIllustrative packaging image, not the actual product

What is Bromobenzene?

Plain description, key identifiers and synonyms

Bromobenzene is the simplest member of the class of bromobenzenes, that is benzene in which a single hydrogen has been substituted by a bromine. A liquid at room temperature (m.p. 30C, b.p.760 156C), it is used as a solvent, particularly for large-scale crystallisations, and for the introduction of phenyl groups in organic synthesis. It has a role as a non-polar solvent, a hepatotoxic agent and a mouse metabolite. It is a volatile organic compound, a bromoarene and a member of bromobenzenes.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
bromobenzene
CAS number
108-86-1 CAS number cross-checkedOther or deprecated CAS: 52753-63-6
EC number
203-623-8
Molecular formula
C6H5Br
UNII
CO4D5J547L
MDL number
MFCD00000055
InChIKey
QARVLSVVCXYDNA-UHFFFAOYSA-N
InChI
InChI=1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H
SMILES (canonical and isomeric)
C1=CC=C(C=C1)Br

Synonyms

  • Monobromobenzene
  • Phenyl bromide
  • Benzene, bromo-
  • C6H5Br
  • PhBr
  • Bromo-benzene
  • 1-Bromobenzene
  • 4-bromobenzene
  • Phenylbromide
  • Pirfenidone EP Impurity D
  • Bromobenzene 100 microg/mL in Methanol
  • Bromobenzol
  • bromo benzene
  • 3-bromobenzene
  • brombenzene
  • brombenzol
  • bromobezene
  • 2-Bromobenzene
  • 1-bromo-benzene
  • 1-Bromobenzene, Bromobenzene, Bromobenzol, Monobromobenzene, NSC 6529, Phenyl bromide
  • Pirfenidone Impurity 33
  • Bromobenzene- d5
  • Bromobenzene [UN2514] [Flammable liquid]
  • Bromobenzene, LR, >=99%
  • Bromobenzene, >=99.5% (GC)
Show all 30 synonyms
  • Bromobenzene, ReagentPlus(R), 99%
  • Bromobenzene, for synthesis, 99.5%
  • UN 2514
  • Bromobenzene(Discontinued,See C4X-222933)
  • Bromobenzene Solution in Methanol, 1000_g/mL

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

Appearance
Mobile liquidexp.
Odour
AROMATIC ODORexp.
Melting point
-30.6 °Cexp.
Boiling point
156.2 °Cexp.
Density
Relative density (water = 1): 1.5exp.
Flash point
51 °Cexp.
Autoignition temperature
565 °Cexp.
Solubility
MISCIBLE WITH CHLOROFORM, BENZENE, PETROLEUM HYDROCARBONS, SOL IN ALCOHOL (10.4 G/100 G @ 25 °C), IN ETHER (71.3 G/100 G @ 25 °C), PRACTICALLY INOL IN WATER (0.045 G/100 G @ 30 °C)exp.
Vapour pressure
4.18 MM HG @ 25 °Cexp.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
157.01 g/molcalc.
Exact mass
155.9575 Dacalc.
LogP (octanol/water)
2.45calc.
Topological polar surface area
0 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
0calc.
Rotatable bonds
0calc.
Heavy atoms
7calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS02: Flammable
Flammable
GHS07: Harmful or irritant
Harmful or irritant
GHS09: Hazardous to the environment
Hazardous to the environment
220NFPA 704 rating

Hazard statements

  • H226Flammable liquid and vapour.
  • H315Causes skin irritation.
  • H411Toxic to aquatic life with long lasting effects.
Precautionary statements (18)
  • P210Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
  • P233Keep container tightly closed.
  • P240Ground and bond container and receiving equipment.
  • P241Use explosion-proof electrical, ventilating and lighting equipment.
  • P242Use non-sparking tools.
  • P243Take action to prevent static discharges.
  • P264Wash skin thoroughly after handling.
  • P273Avoid release to the environment.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P303 + P361 + P353If on skin (or hair): Take off immediately all contaminated clothing. Rinse skin with water or shower.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P332 + P317If skin irritation occurs: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P370 + P378In case of fire: Use appropriate media to extinguish.
  • P391Collect spillage.
  • P403 + P235Store in a well-ventilated place. Keep cool.
  • P501Dispose of contents and container in accordance with local regulations.
UN number
UN 2514
Transport hazard class
3
Packing group
III

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Bromobenzene suppliers

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Bromobenzene price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

In org synthesis, esp to make phenyl magnesium bromide, as additive to motor oils, as solvent, esp for crystallizations on a large scale & where a heavy liq is desirable.

Solvent, top-cylinder compounds, crystallizing solvent, organic synthesis, lubricating-oil additive.

Industrial uses: Other.

Roles

  • aetiopathogenetic role
  • animal metabolite
  • eukaryotic metabolite
  • hepatotoxic agent
  • mammalian metabolite
  • metabolite
  • mouse metabolite
  • non-polar solvent
  • solvent

How it is made

Bromination of benzene in the presence of iron

Prepd industrially by action of bromide on benzene in presence of iron powder, alternate procedure using pyridine as halogen carrier.

Regulatory status

Inventories, regulations and trade controls that list this substance

Europe

  • EU harmonised classification (CLP Annex VI)
    Index no: 602-060-00-9

United States

  • TSCA inventory (USA)
    Status: Active in US commerce, Regulatory flags: Proposed section 4 test rule

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Bromobenzene is traded under.

HS 2903.99Indicative HS code

Halogenated derivatives of aromatic hydrocarbons, other

World exports in 2024
$798M
−15.8% vs 2023, imports $786M
2019 to 2024
Top exporters
  1. China51.0%
  2. United States15.9%
  3. Belgium8.6%
Top importers
  1. India * partner reported16.1%
  2. United States14.7%
  3. Germany10.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Bromobenzene is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Bromobenzene, based on the data on this page

What is Bromobenzene?

Bromobenzene is the simplest member of the class of bromobenzenes, that is benzene in which a single hydrogen has been substituted by a bromine. A liquid at room temperature (m.p.

What is the CAS number of Bromobenzene?

The CAS registry number of Bromobenzene is 108-86-1. Other or deprecated CAS numbers: 52753-63-6.

What is the molecular formula and weight of Bromobenzene?

The molecular formula of Bromobenzene is C6H5Br and its molar mass is 157.01 g/mol.

What is Bromobenzene used for?

In org synthesis, esp to make phenyl magnesium bromide, as additive to motor oils, as solvent, esp for crystallizations on a large scale & where a heavy liq is desirable. Solvent, top-cylinder compounds, crystallizing solvent, organic synthesis, lubricating-oil additive. Industrial uses: Other.

Is Bromobenzene hazardous?

Bromobenzene carries the GHS signal word "Warning". Main hazards: flammable liquid and vapour, causes skin irritation, toxic to aquatic life with long lasting effects. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Bromobenzene?

Bromobenzene is usually classified under HS code 290399 (Halogenated derivatives of aromatic hydrocarbons, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bromobenzene?

CompoundList lists 96 suppliers of Bromobenzene in China, India, United States, United Kingdom and 11 more. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

Where can I buy Bromobenzene in India?

28 suppliers in India list Bromobenzene on CompoundList. Filter the suppliers list by country and send a request to compare prices, grades and delivery times.

What is the price of Bromobenzene?

Suppliers quote Bromobenzene on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Bromobenzene

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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