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CS-W001157 4
Total: USD 88.00

6-Amino-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

  • CAS No. 105807-80-5

  • Cat. No. CS-0076435
  • Molecule weight178.19
  • Purity≥97%
  • MDL No.MFCD01834022

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

6-Amino-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one|CS-0076435

Structure of 105807-80-5

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General Information

  • CAS No. 105807-80-5
  • Cat. No. CS-0076435
  • Purity ≥97%
  • MDL No. MFCD01834022
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O₂
  • Molecular Weight 178.19
  • Synonym(s) 6-amino-2-methyl-2H-1,4-benzoxazin-3(4H)-one
  • SMILES O=C1NC2=C(OC1C)C=CC(N)=C2

Synthesis

  • Route1
    • 2-Methyl-6-nitro-2H-1,4-benzoxazin-3(4H)-one|CS-0204622
      57463-01-1
    • ~81%
    • 6-Amino-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one|CS-0076435
      105807-80-5

    References

    • Shridhar, D. R.; Rao, K. Srinivasa; Singh, A. N.; Rastogi, K.; Jain, M. L.; et al. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1985 , vol. 24, p. 1263 - 1267
  • Route2
    • null|null
      903631-42-5
    • ~%
    • 6-Amino-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one|CS-0076435
      105807-80-5

    References

    • European Journal of Medicinal Chemistry, , vol. 10, # 1 p. 37 - 42
  • Route3
    • 2,4-Diaminophenol|CS-0040104
      95-86-3
    • null|null
      535-11-5
    • ~%
    • 6-Amino-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one|CS-0076435
      105807-80-5

    References

    • European Journal of Medicinal Chemistry, , vol. 10, # 1 p. 37 - 42

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   64.35
  • LogP   0.9882
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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