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CS-W001157 4
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(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)methanol

  • CAS No. 72768-97-9

  • Cat. No. CS-M2545
  • Purity≥98%
  • MDL No.MFCD06202699

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

(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)methanol|CS-M2545

Structure of 72768-97-9

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General Information

  • CAS No. 72768-97-9
  • Cat. No. CS-M2545
  • Purity ≥98%
  • MDL No. MFCD06202699
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₂O₃
  • Molecular Weight 188.13
  • Synonym(s) 2,2-Difluoro-5-(hydroxymethyl)-1,3-benzodioxole
  • SMILES FC1(F)OC2=CC(CO)=CC=C2O1

Synthesis

  • Route1

    References

    • VERTEX PHARMACEUTICALS INCORPORATED Patent: WO2009/73757 A1, 2009 ; Location in patent: Page/Page column 20 ;
  • Route2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED Patent: WO2007/21982 A2, 2007 ; Location in patent: Page/Page column 64 ;
  • Route3

    References

    • DAINIPPON SUMITOMO PHARMA CO., LTD. Patent: US2012/225876 A1, 2012 ; Location in patent: Page/Page column 59 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.69
  • LogP   1.5004
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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