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rel-1,1-Dimethylethyl (4aR,8aR)-octahydro-6-oxo-2(1H)-isoquinolinecarboxylate

  • CAS No. 146610-24-4

  • Cat. No. CS-0463844
  • Purity≥98%
  • MDL No.MFCD21602370

*For research and further manufacturing use only, not for direct human use.

rel-1,1-Dimethylethyl (4aR,8aR)-octahydro-6-oxo-2(1H)-isoquinolinecarboxylate|CS-0463844

Structure of 146610-24-4

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General Information

  • CAS No. 146610-24-4
  • Cat. No. CS-0463844
  • Purity ≥98%
  • MDL No. MFCD21602370
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₃NO₃
  • Molecular Weight 253.34
  • Synonym(s) rac trans-N-Boc-octahydro-isoquinolin-6-one
  • SMILES O=C(N(CC[C@]1([H])C2)C[C@]1([H])CCC2=O)OC(C)(C)C

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   46.61
  • LogP   2.6126
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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