2-Bromo-5-pyrimidinol

Basic Information

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CAS Number

1240621-87-7

Molecular Formula

C4H3BrN2O

Molecular Weight

174.99 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=C(C=NC(=N1)Br)O

InChI

InChI=1S/C4H3BrN2O/c5-4-6-1-3(8)2-7-4/h1-2,8H

InChIKey

QHUDDDWGZQPDIC-UHFFFAOYSA-N

LogP

0.9447000000000001

Topological Polar Surface Area

46.010000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

72.4

Synonyms & References

English

EN300-208374
PB31459
2-BROMO-5-PYRIMIDINOL
2-BROMO-5-HYDROXYPYRIMIDINE
SY024555
2-bromopyrimidin-5-ol
A855926
AKOS015892486
1240621-87-7
DS-17373
C4H3BrN2O
MFCD09953508
CS-0043736
5-Pyrimidinol, 2-bromo-
J-508545
QHUDDDWGZQPDIC-UHFFFAOYSA-N
AMY19934
SCHEMBL457025
DTXSID50676936
2-Bromopyrimidin-5-ol
2-Bromo-5-hydroxypyrimidine
5-hydroxy-2-bromopyrimidine

MDL Number

MFCD09953508

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 2-Bromo-5-pyrimidinol (CAS: 1240621-87-7)?

2-Bromo-5-pyrimidinol is a white crystalline solid with a molecular weight of approximately 186.03 g/mol. It is slightly soluble in water and less soluble in organic solvents. Chemically, it is relatively stable but can react with strong bases or reducing agents. It has a high reactivity towards nucleophiles and can undergo substitution reactions.

How is 2-Bromo-5-pyrimidinol (CAS: 1240621-87-7) typically synthesized?

2-Bromo-5-pyrimidinol is typically synthesized via the reaction of 5-pyrimidinol with bromine in the presence of a base such as sodium hydroxide. The process involves nucleophilic substitution, and the yield can be improved by using appropriate solvents and reaction conditions. The use of a catalyst can enhance the selectivity and efficiency of the reaction.

What industries use 2-Bromo-5-pyrimidinol (CAS: 1240621-87-7)?

2-Bromo-5-pyrimidinol is used in the pharmaceutical industry for the synthesis of antiviral and anticancer drugs. It is also utilized in the polymer industry for the development of functional polymers with specific properties. Additionally, it finds applications in the sensing technology for detecting specific chemical and biological agents.

What precautions should be taken when handling 2-Bromo-5-pyrimidinol (CAS: 1240621-87-7)?

When handling 2-Bromo-5-pyrimidinol, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Proper spill cleanup procedures should be followed, and the material safety data sheet (MSDS) should be consulted for detailed safety information. Ensure the storage of the compound is secure and away from sources of heat or moisture.