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1-Phenylpropane-1,3-diol

  • CAS No. 4850-49-1

  • Cat. No. CS-0156510
  • Purity≥95%
  • MDL No.MFCD00033357

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

1-Phenylpropane-1,3-diol|CS-0156510

Structure of 4850-49-1

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General Information

  • CAS No. 4850-49-1
  • Cat. No. CS-0156510
  • Purity ≥95%
  • MDL No. MFCD00033357
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂O₂
  • Molecular Weight 152.19
  • Synonym(s) 1-Phenyl-1,3-propanediol
  • SMILES C1=CC=C(C=C1)C(CCO)O

Synthesis

  • Route1

    References

    • De Castro, Kathlia A.; Jungnam, Ko; Daejong, Park; Sungdae, Park; Hakjune, Rhee Organic Process Research and Development, 2007 , vol. 11, # 5 p. 918 - 921
  • Route2

    References

    • Okamoto, Tadashi; Oka, Shinzaburo Journal of Organic Chemistry, 1984 , vol. 49, # 9 p. 1589 - 1594
  • Route3

    References

    • Hojo, Makoto; Murakami, Chikara; Fujii, Atsuko; Hosomi, Akira Tetrahedron Letters, 1999 , vol. 40, # 5 p. 911 - 914

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   1.1024
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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