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CS-W001157 4
Total: USD 88.00

4-Bromo-3-methylbenzamide

  • CAS No. 170229-98-8

  • Cat. No. CS-0112707
  • Purity≥97%
  • MDL No.MFCD00672914

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

4-Bromo-3-methylbenzamide|CS-0112707

Structure of 170229-98-8

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General Information

  • CAS No. 170229-98-8
  • Cat. No. CS-0112707
  • Purity ≥97%
  • MDL No. MFCD00672914
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈BrNO
  • Molecular Weight 214.06
  • Synonym(s) 4-Bromo-3-methylbenzenecarboxamidamide
  • SMILES O=C(N)C1=CC=C(Br)C(C)=C1

Synthesis

  • Route1
    • In-stock
      4-Bromo-3-methylbenzonitrile|CS-W002159
      41963-20-6
    • null|null
      75-24-1
    • ~99%
    • In-stock
      4-Bromo-3-methylbenzamide|CS-0112707
      170229-98-8

    References

    • Bristol-Myers Squibb Company Patent: US5780473 A1, 1998 ; US 5780473 A
  • Route2
    • null|null
      1336-21-6
    • null|null
      79-37-8
    • In-stock
      4-Bromo-3-methylbenzoic acid|CS-W002178
      7697-28-1
    • ~89%
    • In-stock
      4-Bromo-3-methylbenzamide|CS-0112707
      170229-98-8

    References

    • Bristol-Myers Squibb Company Patent: US5827869 A1, 1998 ; US 5827869 A
  • Route3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 21, # 2 p. 644 - 651

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   1.85642
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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