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CS-W001157 4
Total: USD 88.00

2-[(4-bromophenyl)methanesulfonyl]acetic acid

  • CAS No. 81431-45-0

  • Cat. No. CS-0248528
  • Molecule weight293.13
  • Purity≥97%
  • MDL No.None

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

2-[(4-bromophenyl)methanesulfonyl]acetic acid|CS-0248528

Structure of 81431-45-0

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General Information

  • CAS No. 81431-45-0
  • Cat. No. CS-0248528
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉BrO₄S
  • Molecular Weight 293.13
  • Synonym(s) 2-(4-Bromobenzylsulfonyl)acetic acid
  • SMILES C1=C(C=CC(=C1)Br)CS(=O)(=O)CC(=O)O

Synthesis

  • Route1
    • 2-{[(4-bromophenyl)methyl]sulfanyl}acetic acid|CS-0235281
      17742-50-6
    • ~%
    • 2-[(4-bromophenyl)methanesulfonyl]acetic acid|CS-0248528
      81431-45-0

    References

    • Janczewski, Marian; Ksiezopolski, Jerzy; Rak-Najda, Teresa Polish Journal of Chemistry, 1981 , vol. 55, # 3 p. 535 - 546
  • Route2
    • null|null
      106-38-7
    • ~%
    • 2-[(4-bromophenyl)methanesulfonyl]acetic acid|CS-0248528
      81431-45-0

    References

    • Janczewski, Marian; Ksiezopolski, Jerzy; Rak-Najda, Teresa Polish Journal of Chemistry, 1981 , vol. 55, # 3 p. 535 - 546
  • Route3

    References

    • Janczewski, Marian; Ksiezopolski, Jerzy; Rak-Najda, Teresa Polish Journal of Chemistry, 1981 , vol. 55, # 3 p. 535 - 546

Safety Information

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

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   1.4485
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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