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CS-W001157 4
Total: USD 88.00

4-Bromo-3-methylbenzaldehyde

  • CAS No. 78775-11-8

  • Cat. No. CS-W018591
  • Purity≥96%
  • MDL No.MFCD07787170

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

4-Bromo-3-methylbenzaldehyde|CS-W018591

Structure of 78775-11-8

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General Information

  • CAS No. 78775-11-8
  • Cat. No. CS-W018591
  • Purity ≥96%
  • MDL No. MFCD07787170
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO
  • Molecular Weight 199.05
  • Synonym(s) 4-BROMO-3-METHYL-BENZALDEHYDE
  • SMILES BrC1=C(C=C(C=O)C=C1)C

Synthesis

  • Route1

    References

    • Combs, Andrew P.; Zhu, Wenyu; Crawley, Matthew L.; Glass, Brian; Polam, Padmaja; Sparks, Richard B.; Modi, Dilip; Takvorian, Amy; McLaughlin, Erin; Yue, Eddy W.; Wasserman, Zelda; Bower, Michael; Wei, Min; Rupar, Mark; Ala, Paul J.; Reid, Brian M.; Ellis, Dawn; Gonneville, Lucie; Emm, Thomas; Taylor, Nancy; Yeleswaram, Swamy; Li, Yanlong; Wynn, Richard; Burn, Timothy C.; Hollis, Gregory; Liu, Phillip C. C.; Metcalf, Brian Journal of Medicinal Chemistry, 2006 , vol. 49, # 13 p. 3774 - 3789
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 24, # 10 p. 1149 - 1155
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 49, # 13 p. 3774 - 3789

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.57002
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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