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CS-W001157 4
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2,2-Dimethylhexan-3-ol

  • CAS No. 4209-90-9

  • Cat. No. CS-0323223
  • Molecule weight130.23
  • Purity≥98%
  • MDL No.MFCD00021929

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

2,2-Dimethylhexan-3-ol|CS-0323223

Structure of 4209-90-9

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General Information

  • CAS No. 4209-90-9
  • Cat. No. CS-0323223
  • Purity ≥98%
  • MDL No. MFCD00021929
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₈O
  • Molecular Weight 130.23
  • Synonym(s) 2,2-Dimethyl-3-hexanol
  • SMILES CCCC(C(C)(C)C)O

Synthesis

  • Route1
    • null|null
      110-62-3
    • null|null
      594-19-4
    • ~75%
    • In-stock
      2,2-Dimethylhexan-3-ol|CS-0323223
      4209-90-9

    References

    • Mello, Rossella; Martinez-Ferrer, Jaime; Alcalde-Aragones, Ana; Varea, Teresa; Acerete, Rafael; Gonzalez-Nunez, Maria Elena; Asensio, Gregorio Journal of Organic Chemistry, 2011 , vol. 76, # 24 p. 10129 - 10139
  • Route2
    • null|null
      594-19-4
    • null|null
      123-72-8
    • ~93%
    • In-stock
      2,2-Dimethylhexan-3-ol|CS-0323223
      4209-90-9

    References

    • Heathcock, , Clayton H.; Lampe, John Journal of Organic Chemistry, 1983 , vol. 48, # 23 p. 4330 - 4337
  • Route3

    References

    • Yamamura, Tomoya; Nakatsuka, Hiroshi; Tanaka, Shinji; Kitamura, Masato Angewandte Chemie - International Edition, 2013 , vol. 52, # 35 p. 9313 - 9315 Angew. Chem., 2013 , vol. 125, # 35 p. 9483 - 9485

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.1935
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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