3-Bromo-4,5-difluorobenzaldehyde


Chemical Name: 3-Bromo-4,5-difluorobenzaldehyde
CAS Number: 1143502-70-8
Product Number: AG000B4R(AGN-PC-0WAGFV)
Synonyms:
MDL No:
Molecular Formula: C7H3BrF2O
Molecular Weight: 220.9989

Identification/Properties


Properties
BP:
237.9±35.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
221.001g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
219.934g/mol
Monoisotopic Mass:
219.934g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Bromo-4,5-difluorobenzaldehyde is a versatile compound that finds wide application in chemical synthesis. Due to its unique structure, this compound is particularly useful in the synthesis of various pharmaceuticals and agrochemicals. Its bromo and difluoro functional groups make it a valuable building block for the creation of complex molecular structures. In organic chemistry, 3-Bromo-4,5-difluorobenzaldehyde is often employed as a key intermediate in the production of diverse aromatic compounds through a range of synthetic pathways. Its presence in a reaction mixture can lead to the formation of multiple products, making it a valuable tool for chemists aiming to access a diverse array of compounds for research and industrial purposes.