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CS-W001157 4
Total: USD 88.00

[3-Bromo-4-(propan-2-yloxy)phenyl]methanol

  • CAS No. 454186-08-4

  • Cat. No. CS-0194518
  • Molecule weight245.11
  • Purity≥97%
  • MDL No.None

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

[3-Bromo-4-(propan-2-yloxy)phenyl]methanol|CS-0194518

Structure of 454186-08-4

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General Information

  • CAS No. 454186-08-4
  • Cat. No. CS-0194518
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃BrO₂
  • Molecular Weight 245.11
  • Synonym(s) (3-Bromo-4-isopropoxyphenyl)methanol
  • SMILES CC(C)OC1=C(C=C(C=C1)CO)Br

Synthesis

  • Route1
    • 3-Bromo-4-isopropoxybenzaldehyde|CS-0196353
      191602-84-3
    • ~99%
    • [3-Bromo-4-(propan-2-yloxy)phenyl]methanol|CS-0194518
      454186-08-4

    References

    • FOREST LABORATORIES HOLDINGS LIMITED; SARMA, Pakala, Kumara Savithru; ACHARYA, Vinod, Parameshwaran; KASIBHATLA, Srinivas, Rao; VISWANADHAN, Vellarkad, Narayana; SHEKHAR, Polisetti; BISCHOFF, Alexander Patent: WO2010/127212 A1, 2010 ; Location in patent: Page/Page column 37 ;
  • Route2

    References

    • Wang, You-Chu; Georghiou, Paris E. Organic Letters, 2002 , vol. 4, # 16 p. 2675 - 2678
  • Route3
    • p-Hydroxybenzaldehyde Bisoprolol Impurity|CS-0229513
      123-08-0
    • ~%
    • [3-Bromo-4-(propan-2-yloxy)phenyl]methanol|CS-0194518
      454186-08-4

    References

    • Wang, You-Chu; Georghiou, Paris E. Organic Letters, 2002 , vol. 4, # 16 p. 2675 - 2678

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   29.46
  • LogP   2.7286
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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