4-Bromo-6-(trifluoromethyl)pyrimidine

Basic Information

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CAS Number

785777-89-1

Molecular Formula

C5H2BrF3N2

Molecular Weight

226.98 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

189.4°C at 760 mmHg

Density

1.807

Flash Point

68.3°C

Refractive Index

1.471

SMILES

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C1=C(N=CN=C1Br)C(F)(F)F

InChI

InChI=1S/C5H2BrF3N2/c6-4-1-3(5(7,8)9)10-2-11-4/h1-2H

InChIKey

AGUIEFSLABIYOT-UHFFFAOYSA-N

LogP

2.2579000000000002

Topological Polar Surface Area

25.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

138

Synonyms & References

English

AC-25661
FT-0646554
DS-10563
SCHEMBL2630831
AB56419
Pyrimidine, 4-bromo-6-(trifluoromethyl)-
Z1269143844
4-bromo-6-(trifluoromethyl)pyrimidine
A852462
CS-W019216
C5H2BrF3N2
SY105082
AKOS007930844
AMY23054
785777-89-1
DTXSID60460525
MFCD10574962
EN300-1268435
4-Bromo-6-(trifluoromethyl)pyrimidine
Pyrimidine,4-bromo-6-(trifluoromethyl)-
AGUIEFSLABIYOT-UHFFFAOYSA-N
STL555554
BBL101757
4-(Trifluoromethyl)-6-bromopyrimidine
AB0026727
ST2411218
W8456

MDL Number

MFCD10574962

FAQ

What is 4-Bromo-6-(trifluoromethyl)pyrimidine (CAS: 785777-89-1)?

4-Bromo-6-(trifluoromethyl)pyrimidine is a chemical compound with the CAS number 785777-89-1. It is a white crystalline solid with a molecular formula of C6H3BrF3N2. This compound is highly reactive and has specific physicochemical properties such as a melting point of 125-126°C.

What are the main uses of 4-Bromo-6-(trifluoromethyl)pyrimidine (CAS: 785777-89-1)?

4-Bromo-6-(trifluoromethyl)pyrimidine is primarily used in pharmaceutical research as a precursor for synthesizing various bioactive molecules. It also has applications in organic synthesis and as a reagent in chemical reactions.

Is 4-Bromo-6-(trifluoromethyl)pyrimidine (CAS: 785777-89-1) safe?

4-Bromo-6-(trifluoromethyl)pyrimidine is not considered safe for general use due to its hazardous nature. It is corrosive and potentially toxic. Proper protective measures, such as wearing appropriate personal protective equipment, are essential when handling this compound.

How should 4-Bromo-6-(trifluoromethyl)pyrimidine (CAS: 785777-89-1) be stored?

4-Bromo-6-(trifluoromethyl)pyrimidine should be stored in a cool, dry place away from direct sunlight and heat sources. The compound should be kept in a tightly sealed container to prevent degradation. It is advisable to store it in a fume hood or a well-ventilated area to minimize exposure to air and moisture.