1-Pyrrolidinecarboxylic acid, 2-formyl-, 1,1-dimethylethyl ester


Chemical Name: 1-Pyrrolidinecarboxylic acid, 2-formyl-, 1,1-dimethylethyl ester
CAS Number: 117625-90-8
Product Number: AG003667(AGN-PC-0KK6OP)
Synonyms:
MDL No:
Molecular Formula: C10H17NO3
Molecular Weight: 199.2469

Identification/Properties


Properties
BP:
276.3°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Liquid
Computed Properties
Molecular Weight:
199.25g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
199.121g/mol
Monoisotopic Mass:
199.121g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
232
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



Tert-Butyl 2-formylpyrrolidine-1-carboxylate, a versatile compound used in chemical synthesis, serves as a valuable building block in organic chemistry. This compound plays a crucial role in the production of pharmaceuticals, agrochemicals, and advanced materials due to its unique structural features and reactivity. By acting as a precursor in various reactions, tert-Butyl 2-formylpyrrolidine-1-carboxylate enables the synthesis of complex molecules with specific functionalities. Its ability to undergo selective transformations makes it a strategic choice for designing and creating new compounds with tailored properties and applications.