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CS-W001157 4
Total: USD 88.00

3-(4-Methylphenyl)adamantane-1-carboxylic acid

  • CAS No. 56531-69-2

  • Cat. No. CS-0218107
  • Purity98+%
  • MDL No.None

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

3-(4-Methylphenyl)adamantane-1-carboxylic acid|CS-0218107

Structure of 56531-69-2

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General Information

  • CAS No. 56531-69-2
  • Cat. No. CS-0218107
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₂₂O₂
  • Molecular Weight 270.37
  • Synonym(s) Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, 3-(4-methylphenyl)-
  • SMILES CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)O

Synthesis

  • Route1

    References

    • Webster, Scott P.; Ward, Peter; Binnie, Margaret; Craigie, Eilidh; McConnell, Kirsty M.M.; Sooy, Karen; Vinter, Andy; Seckl, Jonathan R.; Walker, Brian R. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 10 p. 2838 - 2843

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-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.91762
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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