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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

4-Heptanol

  • CAS No. 589-55-9

  • Cat. No. CS-0132313
  • Purity≥97%
  • MDL No.MFCD00021934

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

4-Heptanol|CS-0132313

Structure of 589-55-9

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General Information

  • CAS No. 589-55-9
  • Cat. No. CS-0132313
  • Purity ≥97%
  • MDL No. MFCD00021934
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₆O
  • Molecular Weight 116.20
  • Synonym(s) Dipropylcarbinol
  • SMILES CCCC(O)CCC

Description

4-Heptanol is a linear secondary alcohol featuring a hydroxyl group at the 4-position of a seven-carbon chain. This structure imparts moderate solubility in organic solvents and enhanced stability under standard bench conditions. The molecule serves as a valuable intermediate in synthetic routes requiring controlled polarity and steric profile, particularly in the construction of complex aliphatic frameworks.

Synthesis

  • Route1
    • null|null
      123-19-3
    • ~97%
    • In-stock
      4-Heptanol|CS-0132313
      589-55-9

    References

    • Fleischer, Steffen; Zhou, Shaolin; Junge, Kathrin; Beller, Matthias Angewandte Chemie - International Edition, 2013 , vol. 52, # 19 p. 5120 - 5124 Angew. Chem., 2013 , vol. 125, # 19 p. 5224 - 5228
  • Route2
    • In-stock
      Dehydroacetic acid|CS-4810
      520-45-6
    • ~12%
    • null|null
      123-19-3
    • In-stock
      4-Heptanol|CS-0132313
      589-55-9

    References

    • WO2013/70966 A1, ; Paragraph 0087 ;
  • Route3
    • In-stock
      Dehydroacetic acid|CS-4810
      520-45-6
    • ~17%
    • null|null
      108-11-2
    • null|null
      142-82-5
    • In-stock
      4-Heptanol|CS-0132313
      589-55-9

    References

    • WO2013/70966 A1, ; Paragraph 0091 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1987
Class : 3
Packing Group : Ⅲ
Hazard Statements : H225-H302
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P270-P280-P330-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   1.9475
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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