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  • 642002 - (3S,5R,8aS)-(+)-Hexahydro-3-phenyl-5H-oxazolo[3,2-a]pyridine-5-carbonitrile

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642002 Sigma-Aldrich

(3S,5R,8aS)-(+)-Hexahydro-3-phenyl-5H-oxazolo[3,2-a]pyridine-5-carbonitrile

97%

Synonym: (+)-2-Cyano-6-phenyloxazolopiperidine, [3S-(3α,5β,8aβ)]-Hexahydro-3-phenyl-5H-oxazolo[3,2-a]pyridine-5-carbonitrile

  • CAS Number 106565-71-3

  • Empirical Formula (Hill Notation) C14H16N2O

  • Molecular Weight 228.29

  •  MDL number MFCD08276761

  •  PubChem Substance ID 24883163

  •  NACRES NA.22

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Properties

Related Categories Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Heterocyclic Building Blocks, Pyridines More...
Quality Level   100
assay   97%
mp   79-83 °C (lit.)
SMILES string   [H][C@]12CCC[C@H](C#N)N1[C@H](CO2)c3ccccc3
InChI   1S/C14H16N2O/c15-9-12-7-4-8-14-16(12)13(10-17-14)11-5-2-1-3-6-11/h1-3,5-6,12-14H,4,7-8,10H2/t12-,13-,14+/m1/s1
InChI key   GQHMNZGZXHZLEN-MCIONIFRSA-N

Description

Application

(3S,5R,8aS)-(+)-Hexahydro-3-phenyl-5H-oxazolo[3,2-a]pyridine-5-carbonitrile can be used as a starting material:
• To prepare spirocyclic aminochroman derivatives as possible 5-HT1A agonists.
• In the asymmetric synthesis of aza-analogs of podophyllotoxin as potent antitumor agents.

Packaging

1 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 2
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Protocols & Articles
Peer-Reviewed Papers
15

References

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