1-Pyrrolidinecarboxylic acid, 3-(bromomethyl)-, 1,1-dimethylethyl ester


Chemical Name: 1-Pyrrolidinecarboxylic acid, 3-(bromomethyl)-, 1,1-dimethylethyl ester
CAS Number: 305329-97-9
Product Number: AG0030FC(AGN-PC-04Q6NQ)
Synonyms:
MDL No: MFCD06410515
Molecular Formula: C10H18BrNO2
Molecular Weight: 264.1594

Identification/Properties


Properties
BP:
300.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
264.163g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
263.052g/mol
Monoisotopic Mass:
263.052g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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



The tert-Butyl 3-(bromomethyl)pyrrolidine-1-carboxylate is a versatile compound widely utilized in chemical synthesis processes. Its unique structure featuring a pyrrolidine ring with a bromomethyl group attached makes it a valuable building block in the creation of various organic molecules. This compound is commonly employed in the synthesis of pharmaceutical intermediates, agrochemicals, and advanced materials due to its reactivity and ability to introduce specific functional groups with precision. Additionally, tert-Butyl 3-(bromomethyl)pyrrolidine-1-carboxylate serves as an essential tool in the development of novel chemical entities with diverse applications in the field of organic chemistry. Its strategic incorporation in synthetic pathways enables the efficient construction of complex molecular structures, making it a fundamental component in the realm of chemical synthesis.