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CS-W001157 4
Total: USD 88.00

3,7-Dimethyloctan-3-ol

  • CAS No. 78-69-3

  • Cat. No. CS-W016195
  • Purity≥98%
  • MDL No.MFCD00004482

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

3,7-Dimethyloctan-3-ol|CS-W016195

Structure of 78-69-3

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General Information

  • CAS No. 78-69-3
  • Cat. No. CS-W016195
  • Purity ≥98%
  • MDL No. MFCD00004482
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₂₂O
  • Molecular Weight 158.29
  • Synonym(s) 3,7-Dimethyl-3-octanol
  • SMILES CCC(O)(C)CCCC(C)C

Description

3,7-Dimethyloctan-3-ol is a tertiary alcohol featuring a branched hydrocarbon backbone with two methyl groups at the C3 position and a terminal hydroxyl group. This structure confers high thermal stability and low volatility, making it ideal for use in fragrance formulations and as a solvent in organic synthesis. The steric bulk around the hydroxyl group enhances resistance to oxidation and dehydration under standard conditions.

Application

3,7-Dimethyloctan-3-ol serves as a stable, bench-ready tertiary alcohol scaffold for the synthesis of terpene-derived building blocks and chiral auxiliaries. Its steric bulk and functional group tolerance enable reliable use in esterification, protection, and coupling reactions. The molecule functions effectively as a precursor in natural product synthesis and offers predictable reactivity in standard organic transformations.

Synthesis

  • Route1
    • In-stock
      Linalool,98% stabilized with MEHQ|CS-0008916
      78-70-6
    • ~82%
    • In-stock
      3,7-Dimethyloctan-3-ol|CS-W016195
      78-69-3
    • null|null
      2270-57-7

    References

    • Advanced Synthesis and Catalysis, , vol. 354, # 8 p. 1437 - 1442
  • Route2

    References

    • Angewandte Chemie, , vol. 94, # 2 p. 153 - 154
  • Route3

    References

    • Santana, Diogo S.; Lima, Marcio V. F.; Daniel, Jorge R. R.; Navarro, Marcelo Tetrahedron Letters, 2003 , vol. 44, # 25 p. 4725 - 4727

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H317-H319
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   20.23
  • LogP   2.9737
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   5

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