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CS-W001157 4
Total: USD 88.00

(4-(Bromomethyl)phenyl)methanol

  • CAS No. 71831-21-5

  • Cat. No. CS-W018775
  • Purity≥97%
  • MDL No.MFCD08275218

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

(4-(Bromomethyl)phenyl)methanol|CS-W018775

Structure of 71831-21-5

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General Information

  • CAS No. 71831-21-5
  • Cat. No. CS-W018775
  • Purity ≥97%
  • MDL No. MFCD08275218
  • Storage -20°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrO
  • Molecular Weight 201.06
  • Synonym(s) 4-BROMO METHYLBENZYL ALCOHOL
  • SMILES OCC1=CC=C(CBr)C=C1

Synthesis

  • Route1
    • p-(Methoxycarbonyl)benzyl bromide|CS-W008845
      2417-72-3
    • ~99%
    • In-stock
      (4-(Bromomethyl)phenyl)methanol|CS-W018775
      71831-21-5

    References

    • Bridger, Gary J.; Skerlj, Renato T.; Hernandez-Abad, Pedro E.; Bogucki, David E.; Wang, Zhongren; Zhou, Yuanxi; Nan, Susan; Boehringer, Eva M.; Wilson, Trevor; Crawford, Jason; Metz, Markus; Hatse, Sigrid; Princen, Katrien; De Clercq, Erik; Schols, Dominique Journal of Medicinal Chemistry, 2010 , vol. 53, # 3 p. 1250 - 1260
  • Route2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED; CHARRIER, Jean-Damien; BINCH, Haley, Marie; HURLEY, Dennis, James; CLEVELAND, Thomas; JOSHI, Pramod; FANNING, Lev Tyler, Dewey; PINDER, Joanne; O'DONNELL, Michael; VIRANI, Anisa, Nizarali; KNEGTEL, Ronald, Marcellus Alphonsus; DURRANT, Steven, John; YOUNG, Stephen, Clinton; PIERRE-HENRI; KAY, David; REAPER, Philip, Michael Patent: WO2011/143426 A1, 2011 ; Location in patent: Page/Page column 76 ; WO 2011/143426 A1
  • Route3
    • 1,4-Benzenedimethanol Plerixafor Impurity|CS-0214162
      589-29-7
    • ~94%
    • In-stock
      (4-(Bromomethyl)phenyl)methanol|CS-W018775
      71831-21-5

    References

    • Mokhtary, Masoud; Lakouraj, Moslem M. Bulletin of the Chemical Society of Ethiopia, 2012 , vol. 26, # 2 p. 305 - 309

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS09
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314-H317-H400
Precautionary Statements : P260-P261-P264-P270-P272-P273-P280-P301+P330+P331-P304+P340-P363-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.0738
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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