Iodobenzene | CAS No. 591-50-4

Iodobenzene

Basic Information

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CAS Number

591-50-4

Molecular Formula

C6H5I

Molecular Weight

204.01 g/mol

EINECS

209-719-6

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Clear yellow

Melting Point

-29 °C

Boiling Point

188 °C

Density

1.823 g/mL at 25 °C

Water Solubility

insoluble

Flash Point

74 °C

Solubility

0.34g/l (experimental)

Refractive Index

n20/D 1.62(lit.)

SMILES

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C1=CC=C(C=C1)I

InChI

InChI=1S/C6H5I/c7-6-4-2-1-3-5-6/h1-5H

InChIKey

SNHMUERNLJLMHN-UHFFFAOYSA-N

LogP

2.2912

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

46.1

Safety Information

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GHS Hazard Pictograms

H302

H319

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

Light Sensitive

Synonyms & References

English

F1908-0074
AI3-16898
Iodobenzene, puriss., >=99.0% (GC)
BCP22486
AMY10020
SCHEMBL1587
A832185
IODOBENZENE [HSDB]
591-50-4
Iodobenzene--d2
NSC9244
SB66617
D77691
DTXSID8060452
IODOPHENYL
STR02365
NSC-9244
CS-W008603
UNII-9HK5L7YBBR
9HK5L7YBBR
Iodo benzene
Iodobenzene, 98%
2-iodo-benzene
HSDB 7859
Phenyl iodide
CHEMBL116296
Iodo-benzene
FT-0627260
InChI=1/C6H5I/c7-6-4-2-1-3-5-6/h1-5
iodiobenzene
PHENYLIODIDE

MDL Number

MFCD00001029

EC Number

209-719-6

Customs Code

29036990

FAQ

What is Iodobenzene (CAS: 591-50-4)?

Iodobenzene is an organic compound with the chemical formula C6H5I. It is a colorless to pale yellow liquid with a distinctive odor. Iodobenzene is known for its high reactivity and is commonly used as an intermediate in chemical synthesis. Its molecular structure consists of a benzene ring substituted with an iodine atom, making it a valuable starting material in the production of various pharmaceuticals and dyes.

What are the main uses of Iodobenzene (CAS: 591-50-4)?

Iodobenzene is primarily used in the pharmaceutical industry for the synthesis of iodinated compounds and drugs. It also finds applications in organic chemistry research, dye manufacturing, and as a precursor in the production of other iodinated aromatic compounds. Additionally, it is used in some industrial processes and as a solvent in specific applications due to its solubility properties.

Is Iodobenzene (CAS: 591-50-4) safe?

Iodobenzene is toxic if inhaled, ingested, or absorbed through the skin. It should be handled with appropriate protective equipment, such as gloves and goggles, and in a well-ventilated area. Safety standards recommend avoiding prolonged exposure and following OSHA guidelines for chemical handling. It is classified as a hazardous substance and requires careful storage and disposal to ensure safety.

How should Iodobenzene (CAS: 591-50-4) be stored?

Iodobenzene should be stored in a cool, dry, and well-ventilated area, away from light and incompatible materials. It is typically kept in sealed glass or plastic containers in a controlled environment at temperatures below 25°C. Due to its reactivity, it should be protected from moisture and stored in a fume cupboard or under an inert atmosphere to maintain stability and safety.