6-(Trifluoromethyl)-4-pyrimidinamine

Basic Information

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CAS Number

672-41-3

Molecular Formula

C5H4F3N3

Molecular Weight

163.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

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C1=C(N=CN=C1N)C(F)(F)F

InChI

InChI=1S/C5H4F3N3/c6-5(7,8)3-1-4(9)11-2-10-3/h1-2H,(H2,9,10,11)

InChIKey

FIAIKJQZLXLGCR-UHFFFAOYSA-N

LogP

1.0776000000000001

Topological Polar Surface Area

51.8 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

135

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

4-Amino-6-Trifluoromethylpyrimidine
DTXSID30625326
AMY5878
4-Pyrimidinamine, 6-(trifluoromethyl)-
6-Trifluoromethyl pyrimidin-4-ylamine
6-(TRIFLUOROMETHYL)PYRIMIDIN-4-AMINE
Z1198177322
6-Trifluoromethyl-pyrimidin-4-ylamine
F2124-0885
AKOS000320400
SCHEMBL27722
672-41-3
CHEMBL3764475
FT-0649230
8XF
BDBM50145925
4-TRIFLUOROMETHYL-6-AMINOPYRIMIDINE
AC-25662
CS-W018728
A9026
EN300-238190
6-(Trifluoromethyl)pyrimidin-4-amine, AldrichCPR
FS-2818
MFCD08436657
AB45006
SY106967
4-AMINO-6-(TRIFLUOROMETHYL)PYRIMIDINE
6-Trifluoromethylpyrimidin-4-ylamine
6-(Trifluoromethyl)pyrimidin-4-amine
6-(Trifluoromethyl)-9H-purin-2-amine
FIAIKJQZLXLGCR-UHFFFAOYSA-N

MDL Number

MFCD08436657

Customs Code

2933599090

FAQ

What regulatory guidelines apply to 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3)?

6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) falls under the scope of the REACH regulation in the European Union, which requires registration for substances above a certain tonnage. Additionally, it is classified and labeled according to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which includes health hazards such as skin and eye irritation. In the United States, the Environmental Protection Agency (EPA) and Food and Drug Administration (FDA) may have specific requirements for handling and disposal depending on its intended use.

Are there alternatives to 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) in synthesis?

There are several alternatives to 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) in synthesis, including other pyrimidines and analogous compounds. For example, 5-(trifluoromethyl)pyrimidines and 4-(trifluoromethyl)pyrimidines can serve as functional analogs. In some cases, isomers or similar compounds such as 6-(difluoromethyl)-4-pyrimidinamine can be used as substitutes.

What is the market or research trend for 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3)?

The market for 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) is driven by its use in pharmaceuticals, particularly as a precursor for drug synthesis. Research trends suggest increasing interest in its application in antiviral and anticancer therapies. Market demand is expected to grow as new applications are discovered, particularly in the development of novel drugs targeting specific molecular pathways.

How should waste containing 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) be handled?

Waste containing 6-(Trifluoromethyl)-4-pyrimidinamine (CAS: 672-41-3) should be collected in properly labeled containers and handled according to local regulations. Incineration is a common method for disposing of such waste, but professional waste disposal services should be used to ensure compliance with environmental protection standards. It is crucial to follow all safety precautions and ensure that waste is disposed of in a manner that does not pose a risk to human health or the environment.