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CS-W001157 4
Total: USD 88.00

1-Adamantaneethanol

  • CAS No. 6240-11-5

  • Cat. No. CS-0042437
  • Molecule weight180.29
  • Purity≥98%
  • MDL No.MFCD00074756

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

1-Adamantaneethanol|CS-0042437

Structure of 6240-11-5

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General Information

  • CAS No. 6240-11-5
  • Cat. No. CS-0042437
  • Purity ≥98%
  • MDL No. MFCD00074756
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₀O
  • Molecular Weight 180.29
  • Synonym(s) None
  • SMILES OCCC12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3

Description

1-Adamantaneethanol offers a rigid, three-dimensional scaffold ideal for steric shielding in molecular design. This bench-stable, moisture-tolerant alcohol integrates readily into functionalized intermediates and serves as a robust building block in medicinal chemistry and materials science applications.

Synthesis

  • Route1
    • 2-(Adamantan-1-yl)ethyl acetate|CS-0962741
      29817-45-6
    • ~98%
    • In-stock
      1-Adamantaneethanol|CS-0042437
      6240-11-5

    References

    • Salomon, Claudio J.; Mata, Ernesto G.; Mascaretti, Oreste A. Journal of Organic Chemistry, 1994 , vol. 59, # 24 p. 7259 - 7266
  • Route2
    • Methyl 2-(adamantan-1-yl)acetate|CS-0314159
      27174-71-6
    • ~45%
    • In-stock
      1-Adamantaneethanol|CS-0042437
      6240-11-5

    References

    • Asahi Kasei Kogyo Kabushiki Kaisha Patent: US5658923 A1, 1997 ; US 5658923 A
  • Route3

    References

    • Bulletin of the Chemical Society of Japan, , vol. 41, # 1 p. 238 - 240

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

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.5852
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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