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3-methyl-3-phenylbutan-1-ol

  • CAS No. 21438-74-4

  • Cat. No. CS-0073186
  • Molecule weight164.24
  • Purity≥97%
  • MDL No.MFCD13188501

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

3-methyl-3-phenylbutan-1-ol|CS-0073186

Structure of 21438-74-4

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General Information

  • CAS No. 21438-74-4
  • Cat. No. CS-0073186
  • Purity ≥97%
  • MDL No. MFCD13188501
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆O
  • Molecular Weight 164.24
  • Synonym(s) 4-hydroxy-2-methyl-2-phenyl-butane
  • SMILES OCCC(C)(C)C1=CC=CC=C1

Synthesis

  • Route1

    References

    • Sakhabutdinov, A. G.; Usmanova, A. G.; Frolov, P. A.; Kushnarev, D. F.; Schmidt, F. K. Journal of Organic Chemistry USSR (English Translation), 1988 , vol. 24, # 8 p. 1452 - 1455 Zhurnal Organicheskoi Khimii, 1988 , vol. 24, # 8 p. 1610 - 1614
  • Route2
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    • 3-methyl-3-phenylbutan-1-ol|CS-0073186
      21438-74-4

    References

    • Abramovici,M.; Pines,H. Journal of Organic Chemistry, 1969 , vol. 34, p. 266 - 270
  • Route3
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      4111-61-9
    • ~%
    • 3-methyl-3-phenylbutan-1-ol|CS-0073186
      21438-74-4

    References

    • Martinelli,L. et al. Journal of Organic Chemistry, 1972 , vol. 37, # 14 p. 2278 - 2281

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-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.3466
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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