rel-1,1-Dimethylethyl (1R,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate

CAS Registry Number®

198835-02-8

CAS Name

rel-1,1-Dimethylethyl (1R,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate

Molecular Formula

C11H19NO3

Molecular Mass

213.27

Cite this Page

rel-1,1-Dimethylethyl (1R,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=198835-02-8 (retrieved 2024-12-19) (CAS RN: 198835-02-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    90-92 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1/C11H19NO3/c1-11(2,3)15-10(14)12-6-7-4-8(12)9(13)5-7/h7-9,13H,4-6H2,1-3H3/t7-,8+,9+/s2

InChIKey

InChIKey=PABFVGKPNHVSCG-PQCSWJAFNA-N

SMILES

C(OC(C)(C)C)(=O)N1[C@@]2([C@@H](O)C[C@](C1)(C2)[H])[H]

Canonical SMILES

O=C(OC(C)(C)C)N1CC2CC(O)C1C2

Other Names for this Substance

  • 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-hydroxy-, 1,1-dimethylethyl ester, (1R,4S,6R)-rel-
  • 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-hydroxy-, 1,1-dimethylethyl ester, exo-
  • rel-1,1-Dimethylethyl (1R,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate

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