Methyl (1S,2S,3S,5R)-3-[bis(4-fluorophenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

CAS Registry Number®

156774-35-5
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CAS Name

Methyl (1S,2S,3S,5R)-3-[bis(4-fluorophenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

Molecular Formula

C23H25F2NO3

Molecular Mass

401.45

Cite this Page

Methyl (1S,2S,3S,5R)-3-[bis(4-fluorophenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=156774-35-5 (retrieved 2024-04-20) (CAS RN: 156774-35-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    132-133 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H25F2NO3/c1-26-18-11-12-19(26)21(23(27)28-2)20(13-18)29-22(14-3-7-16(24)8-4-14)15-5-9-17(25)10-6-15/h3-10,18-22H,11-13H2,1-2H3/t18-,19+,20+,21+/m1/s1

InChIKey

InChIKey=XSYGBVSQKPLETJ-ANULTFPQSA-N

SMILES

C(OC)(=O)[C@H]1[C@]2(N(C)[C@@](C[C@@H]1OC(C3=CC=C(F)C=C3)C4=CC=C(F)C=C4)(CC2)[H])[H]

Canonical SMILES

O=C(OC)C1C(OC(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3)CC4N(C)C1CC4

Other Names for this Substance

  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-[bis(4-fluorophenyl)methoxy]-8-methyl-, methyl ester, (1S,2S,3S,5R)-
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-[bis(4-fluorophenyl)methoxy]-8-methyl-, methyl ester, [1S-(2-exo,3-endo)]-
  • Methyl (1S,2S,3S,5R)-3-[bis(4-fluorophenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
  • O 620

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