4-Iodo-1H-imidazole

Basic Information

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CAS Number

71759-89-2

Molecular Formula

C3H3IN2

Molecular Weight

193.98 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

136.0 to 140.0 deg-C

Boiling Point

348.5°C at 760 mmHg

Density

2.3360

Flash Point

164.548℃

SMILES

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C1=C(NC=N1)I

InChI

InChI=1S/C3H3IN2/c4-3-1-5-2-6-3/h1-2H,(H,5,6)

InChIKey

BHCMXJKPZOPRNN-UHFFFAOYSA-N

LogP

1.0143

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

48.1

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

Light Sensitive

Synonyms & References

English

SY001996
4-Iodo-1H-imidazole
EN300-113762
4(5)-Iodoimidazole
4-iodo-imidazole
CS-W002802
AKOS015949568
4-Iodoimidazole
MFCD01632213
CL2236
5-iodo-1H-imidazole
4(5)-Iodo-1(H)-imidazole
PS-3339
AM20090545
DTXSID80345704
F2108-0212
4-Iodo-1H-imidazole #
SCHEMBL111849
AB09493
AKOS000280689
BCP09637
4-iodo-
SY275838
U0O
I0812
FT-0618792
1H-Imidazole, 4-iodo-
4-Iodoimidazole, AldrichCPR
HY-W002802
5-iodoimidazole
71759-89-2

MDL Number

MFCD01632213

Customs Code

2933290090

FAQ

What is 4-Iodo-1H-imidazole (CAS: 71759-89-2)?

4-Iodo-1H-imidazole is a heterocyclic organic compound with the chemical formula C3H3IN2. It is a derivative of imidazole, containing an iodine atom at the 4-position. This compound is known for its aromatic ring structure and is commonly used in chemical synthesis. Its CAS number is 71759-89-2.

What are the main uses of 4-Iodo-1H-imidazole (CAS: 71759-89-2)?

4-Iodo-1H-imidazole is widely used in pharmaceutical research as a building block for drug development. It also finds applications in organic chemistry for synthesizing various compounds, including agrochemicals and materials science products. Its unique structure makes it valuable in creating functional molecules with specific biological activities.

Is 4-Iodo-1H-imidazole (CAS: 71759-89-2) safe?

4-Iodo-1H-imidazole is considered hazardous due to its potential to cause skin and eye irritation. It should be handled with care, using appropriate personal protective equipment (PPE) such as gloves and goggles. Safety data sheets (SDS) should be consulted for detailed handling and disposal guidelines.

How should 4-Iodo-1H-imidazole (CAS: 71759-89-2) be stored?

4-Iodo-1H-imidazole should be stored in a cool, dry, and well-ventilated area, away from light. It is typically kept in a sealed container to prevent moisture ingress. Storage conditions should maintain a temperature below 25°C and avoid exposure to incompatible substances to ensure stability and safety.