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CS-W001157 4
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3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carbonitrile

  • CAS No. 86267-86-9

  • Cat. No. CS-0006470
  • Purity≥98%
  • MDL No.MFCD06200862

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

3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carbonitrile|CS-0006470

Structure of 86267-86-9

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General Information

  • CAS No. 86267-86-9
  • Cat. No. CS-0006470
  • Purity ≥98%
  • MDL No. MFCD06200862
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O
  • Molecular Weight 160.17
  • Synonym(s) 3,4-dihydro-2H-1,4-benzoxazine-2-carbonitrile
  • SMILES N#CC1CNC2=CC=CC=C2O1

Synthesis

  • Route1
    • null|null
      95-55-6
    • null|null
      920-37-6
    • ~59%
    • 3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carbonitrile|CS-0006470
      86267-86-9

    References

    • Bartsch, Herbert; Schwarz, Otto Journal of Heterocyclic Chemistry, 1983 , vol. 20, p. 45 - 48
  • Route2
    • 3,4-Dihydro-2h-1,4-benzoxazine-2-carboxamide|CS-0246735
      13582-93-9
    • ~%
    • 3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carbonitrile|CS-0006470
      86267-86-9

    References

    • Journal of Heterocyclic Chemistry, , vol. 22, # 1 p. 177 - 181
  • Route3
    • null|null
      96988-61-3
    • ~%
    • 3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carbonitrile|CS-0006470
      86267-86-9

    References

    • Journal of Heterocyclic Chemistry, , vol. 22, # 1 p. 177 - 181

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   45.05
  • LogP   1.38308
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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