5-Fluoropyrimidin-4-amine

Basic Information

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CAS Number

811450-26-7

Molecular Formula

C4H4FN3

Molecular Weight

113.09 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

Boiling Point

222.7°C at 760 mmHg

Density

1.372

Flash Point

88.5°C

Refractive Index

1.56

SMILES

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C1=C(C(=NC=N1)N)F

InChI

InChI=1S/C4H4FN3/c5-3-1-7-2-8-4(3)6/h1-2H,(H2,6,7,8)

InChIKey

PKZMNMQCFNJXEH-UHFFFAOYSA-N

LogP

0.19790000000000008

Topological Polar Surface Area

51.8 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

77.7

Synonyms & References

English

5-Fluoropyrimidin-4-amine
4- Pyrimidinamine, 5-fluoro-
4-Pyrimidinamine,5-fluoro
5-fluoranylpyrimidin-4-amine
5-fluoro-4-pyrimidinamine
5-FLUORO-PYRIMIDIN-4-YLAMINE
5-fluoro-4-pyrimidineamine
4-amino-5-fluoropyrimidine
4-Pyrimidinamine,5-fluoro-
PKZMNMQCFNJXEH-UHFFFAOYSA-N
BCP21839
AM101307
AB0037781
Y5108
ST24029487
A814346
Z1741979118
5-fluoropyrimidin-4-amine
CS-0044093
SB38851
5-Fluoro-pyrimidin-4-ylamine;4-Pyrimidinamine, 5-fluoro-
811450-26-7
MFCD00223685
DB-349934
AKOS015855608
SCHEMBL2417749
Z1255487690
DTXSID30392849
SY060395
EN300-219063
AC-27296

MDL Number

MFCD00223685

FAQ

What regulatory guidelines apply to 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7)?

5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA guidelines in the United States. It is classified as a hazardous substance due to its potential for skin irritation and sensitization. Companies must ensure proper labeling, storage, and handling to comply with these regulations.

Are there alternatives to 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) in synthesis?

There are several alternatives to 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) in synthesis, including 5-bromopyrimidin-4-amine and 5-chloropyrimidin-4-amine. These alternatives offer similar reactivity but with different functional groups, making them suitable for various synthetic routes. The choice of alternative depends on the specific reaction conditions and desired product purity.

What is the market or research trend for 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7)?

The market for 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) is driven by its use as an intermediate in the synthesis of antimicrobial and antiviral drugs. Research trends indicate an increasing focus on developing more efficient and environmentally friendly synthetic pathways. Additionally, there is growing interest in exploring its potential applications in the development of new pharmaceuticals and agrochemicals.

How should waste containing 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) be handled?

Waste containing 5-Fluoropyrimidin-4-amine (CAS: 811450-26-7) should be collected in a sealed container and properly labeled as a hazardous substance. Incineration or professional waste disposal services should be utilized to ensure complete destruction of the compound. Environmental protection measures, such as the use of appropriate containment facilities and protective equipment, should be followed to prevent contamination of soil and water sources. Compliance with local and national regulations is essential.