4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile

Basic Information

View in Editor

CAS Number

244768-32-9

Molecular Formula

C11H7ClN4

Molecular Weight

230.65 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

216-218°C

Boiling Point

441°Cat760mmHg

Density

1.39

Flash Point

220.5°C

Refractive Index

1.649

SMILES

View in Editor

C1=CC(=CC=C1C#N)NC2=NC=CC(=N2)Cl

InChI

InChI=1S/C11H7ClN4/c12-10-5-6-14-11(16-10)15-9-3-1-8(7-13)2-4-9/h1-6H,(H,14,15,16)

InChIKey

QXCHAADSAYQDHL-UHFFFAOYSA-N

LogP

2.81828

Complexity

266

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

4-((4-Chloropyrimidin-2-yl)amino)benzonitrile
W-206895
A5035
4-[(4-chloro-2-pyrimidinyl)amino)benzonitrile
A1-04830
MFCD08443699
4-[(4-chloropyrimidin-2-yl)amino]benzonitrile
EC 607-384-4
FT-0664940
C11H7ClN4
AKOS015917905
Benzonitrile, 4-[(4-chloro-2-pyrimidinyl)amino]-
CS-0006975
4-(4-Chloro-pyrimidin-2-ylamino)-benzonitrile
CL4549
244768-32-9
4-[(4-Chloro-2-pyrimidinyl)amino]-benzonitrile
HE-0022
4-(4-chloro-pyrimidin-2-ylamino)benzonitrile
4-((4-chloro-2-pyrimidinyl)amino)benzonitrile
SCHEMBL867999
AC-27707
4-[(4chloro-2-pyrimidinyl)amino]benzonitrile
4-N[2(4-CHLOROPYRIMIDINYL)]AMINO BENZONITRILE
NS00005250
4-N[2(4-chloropyrimidinyl)]-amino benzonitrile
4[(4-chloro-2-pyrimidinyl)amino]benzonitrile
4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile
QXCHAADSAYQDHL-UHFFFAOYSA-N
DTXSID90458374
4-(4-chloropyrimidin-2-ylamino)benzonitrile

MDL Number

MFCD08443699

FAQ

What regulatory guidelines apply to 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9)?

4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) and may require classification as a hazardous substance. It is also subject to the European Union's Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulations. For specific FDA and EPA requirements, consult their guidelines and databases for detailed information on handling and disposal.

Are there alternatives to 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9) in synthesis?

In the synthesis of related compounds, alternative reagents such as 4-(4-chloropyrimidin-2-yl)aniline can be used. These compounds often serve similar purposes and can be considered as viable substitutes depending on the specific chemical requirements and synthesis conditions.

What is the market or research trend for 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9)?

The market for 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9) is growing due to its applications in pharmaceuticals and agrochemicals. Research trends focus on its use as an intermediate in drug synthesis and as a fungicide. Market dynamics are influenced by demand in these sectors and regulatory changes affecting chemical usage.

How should waste containing 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9) be handled?

Waste containing 4-[(4-Chloro-2-pyrimidinyl)amino]benzonitrile (CAS: 244768-32-9) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method, but ensure compliance with local regulations. Proper environmental protection measures, including neutralization of chemicals, should be taken to prevent environmental contamination.