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CS-W001157 4
Total: USD 88.00

Methyl 4-mercaptobenzoate

  • CAS No. 6302-65-4

  • Cat. No. CS-0037057
  • Purity≥98%
  • MDL No.MFCD01863423

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

Methyl 4-mercaptobenzoate|CS-0037057

Structure of 6302-65-4

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General Information

  • CAS No. 6302-65-4
  • Cat. No. CS-0037057
  • Purity ≥98%
  • MDL No. MFCD01863423
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₂S
  • Molecular Weight None
  • Synonym(s) Methyl 4-sulfanylbenzoate
  • SMILES COC(=O)C1=CC=C(C=C1)S

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      4-Mercaptobenzoic acid|CS-W018038
      1074-36-8
    • ~88%
    • In-stock
      Methyl 4-mercaptobenzoate|CS-0037057
      6302-65-4

    References

    • UNIVERSITE D'AIX-MARSEILLE; CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE; SELLAMI, Lina; VILLARD, Claude; BRUNEL, Jean Michel; LAFITTE, Daniel Patent: WO2012/152943 A1, 2012 ; Location in patent: Page/Page column 16 ;
  • Route2

    References

    • Bristol-Myers Squibb Co. Patent: US5648385 A1, 1997 ;
  • Route3
    • Dimethyl 4,4'-disulfanediyldibenzoate|CS-0663523
      35190-68-2
    • ~79%
    • In-stock
      Methyl 4-mercaptobenzoate|CS-0037057
      6302-65-4

    References

    • Miles Inc. Patent: US5266713 A1, 1993 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P311-P312-P330-P361-P363-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.7619
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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