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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

Orthocaine

  • CAS No. 536-25-4

  • Cat. No. CS-W005637
  • Purity≥96%
  • MDL No.MFCD00017095

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

Orthocaine|CS-W005637

Structure of 536-25-4

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General Information

  • CAS No. 536-25-4
  • Cat. No. CS-W005637
  • Purity ≥96%
  • MDL No. MFCD00017095
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₃
  • Molecular Weight None
  • Synonym(s) None
  • SMILES COC(C1=CC(N)=C(O)C=C1)=O

Synthesis

  • Route1

    References

    • Ackermann, Jean; Bleicher, Konrad; Ceccarelli, Simona M.; Chomienne, Odile; Mattei, Patrizio; Sander, Ulrike Obst Patent: US2007/191603 A1, 2007 ; Location in patent: Page/Page column 25 ;
  • Route2
    • null|null
      67-56-1
    • In-stock
      3-Amino-4-hydroxybenzoic acid|CS-W010940
      1571-72-8
    • ~10%
    • In-stock
      Orthocaine|CS-W005637
      536-25-4

    References

    • ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA Patent: WO2004/87714 A1, 2004 ; Location in patent: Page 53 ; WO 2004/087714 A1
  • Route3
    • null|null
      67-56-1
    • In-stock
      4-Hydroxy-3-nitrobenzoic acid|CS-W017067
      616-82-0
    • ~92%
    • In-stock
      Orthocaine|CS-W005637
      536-25-4

    References

    • APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. Patent: WO2004/7491 A1, 2004 ; Location in patent: Page 75 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   72.55
  • LogP   0.761
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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