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CS-W001157 4
Total: USD 88.00

3-(Bromomethyl)benzoic acid

  • CAS No. 6515-58-8

  • Cat. No. CS-W007696
  • Purity≥98%
  • MDL No.MFCD00045839

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

3-(Bromomethyl)benzoic acid|CS-W007696

Structure of 6515-58-8

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General Information

  • CAS No. 6515-58-8
  • Cat. No. CS-W007696
  • Purity ≥98%
  • MDL No. MFCD00045839
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO₂
  • Molecular Weight 215.05
  • Synonym(s) Benzoic acid, 3-(bromomethyl)-
  • SMILES O=C(O)C1=CC=CC(CBr)=C1

Synthesis

  • Route1

    References

    • ANTHEM BIOSCIENCES PRIVATE LIMITED Patent: US2012/101099 A1, 2012 ; Location in patent: Page/Page column 22 ;
  • Route2

    References

    • INOTEK PHARMACEUTICALS CORPORATION Patent: WO2005/97123 A2, 2005 ; Location in patent: Page/Page column 79-80 ;
  • Route3

    References

    • Litak, Peter T.; Kauffman, Joel M. Journal of Heterocyclic Chemistry, 1994 , vol. 31, # 2 p. 457 - 480

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302+H312-H314
Precautionary Statements : P260-P264-P270-P280-P304+P340-P330-P362-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.2797
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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