4-(1H-Imidazol-1-yl)benzonitrile

Basic Information

View in Editor

CAS Number

25372-03-6

Molecular Formula

C10H7N3

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

152.0 to 156.0 deg-C

Boiling Point

358.1 °C at 760 mmHg

Density

1.13

Flash Point

170.4 °C

Refractive Index

1.623

SMILES

View in Editor

C1=CC(=CC=C1C#N)N2C=CN=C2

InChI

InChI=1S/C10H7N3/c11-7-9-1-3-10(4-2-9)13-6-5-12-8-13/h1-6,8H

InChIKey

GYFGZFJGMRRTTP-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

210

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Bionet2_001535
AKOS000222274
4-imidazol-1-ylbenzenecarbonitrile
4-(1-imidazolyl)-benzonitrile
4-(1H-Imidazol-1-yl)benzenecarbonitrile
SY033882
4-imidazol-1-yl-benzonitrile
C2045
GYFGZFJGMRRTTP-UHFFFAOYSA-N
4-imidazol-1-ylbenzonitrile
W-206974
YSCH0219
AMY4762
p-Imidazol-1-ylbenzonitrile
4-(1H-imidazol-1-yl)benzonitrile
EN300-366051
12A-005
Z331877032
HMS1368G16
DTXSID70180020
4-(1-Imidazolyl)benzonitrile
A845251
CS-0019010
J-513215
SCHEMBL1009532
25372-03-6
1-(4-Cyanophenyl)imidazole
Benzonitrile, p-imidazol-1-yl-
4-(imidazol-1-yl)benzonitrile
FT-0616792
MFCD00127147

MDL Number

MFCD00127147

FAQ

What regulatory guidelines apply to 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6)?

4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) must comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous communication. In the European Union, it should adhere to REACH regulations, which require registration, evaluation, authorization, and restriction of chemicals. Additionally, FDA and EPA guidelines apply for any pharmaceutical or environmental concerns. Companies should consult the Material Safety Data Sheet (MSDS) for specific handling and disposal instructions.

Are there alternatives to 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) in synthesis?

Alternatives to 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) in synthesis include 1H-imidazole derivatives with different substituents, such as 1-(2-cyanoethyl)-1H-imidazole. Commonly used alternative reagents include anilines and nitriles. Researchers should consider the reactivity and availability of these alternatives to optimize the synthesis process.

What is the market or research trend for 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6)?

The market for 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) is growing due to its use in pharmaceuticals, particularly as a precursor for antiviral drugs. Research trends include exploring its potential in anti-inflammatory and antitumor applications. The demand is expected to increase as novel applications are discovered, driving further studies and industrial adoption.

How should waste containing 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) be handled?

Waste containing 4-(1H-Imidazol-1-yl)benzonitrile (CAS: 25372-03-6) should be collected in appropriate containers and stored separately. Incineration is a common method for disposal, though professional waste treatment facilities handle such waste to ensure environmental safety. Companies should follow local environmental protection regulations and consult with waste management experts for safe and compliant disposal.