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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

tert-butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate

O=C(N1CC(=O)C(C1)(F)F)OC(C)(C)C Request for Quotation
Chemical Name: tert-butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate
CAS Number: 1215071-16-1
Product Number: AG001536(AGN-PC-07YNDS)
Synonyms:
MDL No:
Molecular Formula: C9H13F2NO3
Molecular Weight: 221.2012

Identification/Properties

Computed Properties
Molecular Weight:
221.204g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
221.086g/mol
Monoisotopic Mass:
221.086g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
296
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The tert-Butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate is a versatile compound commonly used in chemical synthesis, specifically in the field of organic chemistry. This compound serves as a key building block for the creation of various complex molecules due to its unique structural properties and reactivity.One of the primary applications of tert-Butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate is in the synthesis of pharmaceuticals. By utilizing this compound as a starting material, chemists can efficiently introduce the 3,3-difluoro-4-oxopyrrolidine-1-carboxylate moiety into drug candidates, thereby enhancing their biological activity and pharmacokinetic properties.Additionally, tert-Butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate is also employed in the preparation of agrochemicals and specialty chemicals. Its fluoro-substituted pyrrolidine core offers a strategic advantage in the design of novel compounds with desirable characteristics, making it a valuable tool for medicinal and industrial chemists alike.Overall, the application of tert-Butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate in chemical synthesis enables the rapid and efficient construction of diverse molecular scaffolds, facilitating the development of innovative products across multiple sectors.