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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 (1S,5R)-7-benzyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

O=C(N1CC2CN(CC(C1)C2=O)Cc1ccccc1)OC(C)(C)C Request for Quotation
Chemical Name: tert-butyl (1S,5R)-7-benzyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate
CAS Number: 227940-70-7
Product Number: AG007NQ2(AGN-PC-00BV7U)
Synonyms:
MDL No: MFCD08274936
Molecular Formula: C19H26N2O3
Molecular Weight: 330.4213

Identification/Properties

Computed Properties
Molecular Weight:
330.428g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
330.194g/mol
Monoisotopic Mass:
330.194g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
462
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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-H332-H335
Precautionary Statements:
P261-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 7-benzyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate is a versatile compound widely used in chemical synthesis due to its unique structural features. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals. Its presence in the molecule allows for the efficient formation of complex structures through functional group manipulations and strategic bond formations. In particular, tert-Butyl 7-benzyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate plays a crucial role in the creation of heterocyclic compounds, which are essential in drug discovery and development. Additionally, this compound is utilized in the modification of natural products and the creation of novel molecules with enhanced biological activities. Its application extends to the preparation of advanced materials and the synthesis of chiral intermediates, contributing significantly to the advancement of chemical research and innovation.