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2,2-Dihydroxy-1-phenylethan-1-one

  • CAS No. 1075-06-5

  • Cat. No. CS-0099611
  • Purity≥96%
  • MDL No.MFCD00149499

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

2,2-Dihydroxy-1-phenylethan-1-one|CS-0099611

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General Information

  • CAS No. 1075-06-5
  • Cat. No. CS-0099611
  • Purity ≥96%
  • MDL No. MFCD00149499
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₃
  • Molecular Weight 152.15
  • Synonym(s) Phenylglyoxal hydrate
  • SMILES OC(O)C(C1=CC=CC=C1)=O

Description

Modifying arginine residues in carbonic anhydrase III, Phenylglyoxal hydrate (CAS 1075-06-5) enables site-specific protein labeling and facilitates synthesis of pyrrolinone and furan heterocycles through nucleophilic addition reactions.

Application

Phenylglyoxal hydrate (CAS 1075-06-5) modifies pig muscle carbonic anhydrase III by selectively targeting arginine residues, enabling precise structural analysis. This reactivity drives the synthesis of pyrrolinone and furan derivatives. These compounds serve as chemiluminescent reporters for sensitive purine detection in biochemical assays.

Synthesis

  • Route1

    References

    • Tafelska-Kaczmarek, Agnieszka; Prewysz-Kwinto, Andrzej; Skowerski, Krzysztof; Pietrasiak, Katarzyna; Kozakiewicz, Anna; Zaidlewicz, Marek Tetrahedron Asymmetry, 2010 , vol. 21, # 18 p. 2244 - 2248
  • Route2

    References

    • Meester, Johan W. G. De; Plas, Henk C. van der; Middelhoven, Wouter J. Journal of Heterocyclic Chemistry, 1987 , vol. 24, p. 441 - 451
  • Route3
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      536-74-3
    • ~49%
    • In-stock
      2,2-Dihydroxy-1-phenylethan-1-one|CS-0099611
      1075-06-5

    References

    • Wan, Zhonghui; Jones, Chauncey D.; Mitchell, David; Pu, John Y.; Zhang, Tony Y. Journal of Organic Chemistry, 2006 , vol. 71, # 2 p. 826 - 828

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

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   0.18
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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