2-Bromo-2-propen-1-ol

Basic Information

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CAS Number

598-19-6

Molecular Formula

C3H5BrO

Molecular Weight

136.98 g/mol

Chemical Classification

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Boiling Point

150°C

Refractive Index

n20/D 1.5037

SMILES

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OCC(=C)Br

InChI

InChI=1S/C3H5BrO/c1-3(4)2-5/h5H,1-2H2

InChIKey

MDFFZNIQPLKQSG-UHFFFAOYSA-N

LogP

0.8873

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

42.2

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

2-BROMOALLYL ALCOHOL
2-BROMO-2-PROPYLENE-1-OL
2-Bromoprop-2-en-1-ol
2-Bromo-2-propen-1-ol
2-Bromo-1-propen-3-ol
2-BROMO-2-PROPENE-1-OL
2-Propen-1-ol, 2-bromo-
2-bromo-prop-2-en-1-ol
2-bromanylprop-2-en-1-ol
KSC268G6J
MDFFZNIQPLKQSG-UHFFFAOYSA-N
NE14246
DB04320
AK102798
A832482
Z1939437384

MDL Number

MFCD09265077

Customs Code

2905590090

FAQ

What are the physical and chemical properties of 2-Bromo-2-propen-1-ol (CAS: 598-19-6)?

2-Bromo-2-propen-1-ol (CAS: 598-19-6) is a colorless to pale yellow liquid with a molecular weight of 132.02 g/mol. It has a characteristic odor and is slightly water-soluble. It is highly reactive, particularly towards nucleophiles and reducing agents. It is prone to elimination and substitution reactions.

How is 2-Bromo-2-propen-1-ol (CAS: 598-19-6) typically synthesized?

2-Bromo-2-propen-1-ol is typically synthesized by bromination of propenal (acrolein) in the presence of a base like sodium hydroxide or potassium hydroxide. The reaction is carried out in an aqueous phase, and the product is isolated by extraction and purification techniques such as distillation.

What industries use 2-Bromo-2-propen-1-ol (CAS: 598-19-6)?

2-Bromo-2-propen-1-ol (CAS: 598-19-6) is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the polymer industry as a monomer or in the production of resins. Its use in sensors and semiconductor applications is limited due to its reactivity and toxicity.

What precautions should be taken when handling 2-Bromo-2-propen-1-ol (CAS: 598-19-6)?

When handling 2-Bromo-2-propen-1-ol (CAS: 598-19-6), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood. Spills should be immediately contained and cleaned up using appropriate absorbents. Users should consult the Safety Data Sheet (SDS) for detailed information on handling and storage.