1'-Boc-1,2-dihydro-2-oxo-spiro[4h-3,1-benzoxazine-4,4'-piperidine]

CAS

84060-08-2

Catalog Number

ACM84060082

Category

Other Products

Molecular Weight

318.371

Molecular Formula

C₁₇H₂₂N₂O₄

MSDS COA Spec Sheet

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Specification

Synonyms

1'-Boc-1,2-Dihydro-2-oxo-spiro[4H-3,1-benzoxazine-4,4'-piperidine];tert-Butyl 2-oxo-1,2-dihydrospiro[benzo[d][1,3]oxazine-4,4'-piperidine]-1'-carboxylate;1,2-Dihydro-2-oxo-spiro[4H-3,1-benzoxazine-4,4'-piperidine]-1'-carboxylic acid 1,1-dimethyl ethyl est

IUPAC Name

tert-butyl 2-oxospiro[1H-3,1-benzoxazine-4,4-piperidine]-1-carboxylate

Canonical SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C3=CC=CC=C3NC(=O)O2

InChI Key

XJSGYDPAFSJFQE-UHFFFAOYSA-N

Boiling Point

415.2ºC at 760 mmHg

Melting Point

83-85ºC

Flash Point

204.9ºC

Density

1.25g/cm³

Exact Mass

318.15800

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

179321-49-4

84060-08-2

Reference: [1] Patent: WO2008/21375, 2008, A2, . Location in patent: Page/Page column 42-43

Upstream Synthesis Route 2

3422-01-3
79099-07-3

84060-08-2

Reference: [1] Journal of Medicinal Chemistry, 1983, vol. 26, # 5, p. 657 - 661
[2] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 22, p. 6441 - 6446
[3] Bioorganic and Medicinal Chemistry Letters, 2012, vol. 22, # 22, p. 6876 - 6881,6

Upstream Synthesis Route 3

3422-01-3
79099-07-3

84060-08-2

Reference: [1]Journal of Medicinal Chemistry,1983,vol. 26,p. 657 - 661
[2]Bioorganic and Medicinal Chemistry Letters,2009,vol. 19,p. 6441 - 6446
[3]Bioorganic and medicinal chemistry letters,2012,vol. 22,p. 6876 - 6881,6