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CS-W001157 4
Total: USD 88.00

Butane-1,2,3-triol

  • CAS No. 4435-50-1

  • Cat. No. CS-0332229
  • Molecule weight106.12
  • Purity≥90%
  • MDL No.MFCD00059662

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

Butane-1,2,3-triol|CS-0332229

Structure of 4435-50-1

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General Information

  • CAS No. 4435-50-1
  • Cat. No. CS-0332229
  • Purity ≥90%
  • MDL No. MFCD00059662
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₁₀O₃
  • Molecular Weight 106.12
  • Synonym(s) 1,2,3-Trihydroxybutane
  • SMILES CC(C(CO)O)O

Synthesis

  • Route1
    • null|null
      504-61-0
    • ~99%
    • Butane-1,2,3-triol|CS-0332229
      4435-50-1

    References

    • Friedrich, Holger B.; Govender, Mayashree; Makhoba, Xolani; Ngcobo, T. Dennis; Onani, Martin O. Chemical Communications, 2003 , # 23 p. 2922 - 2923
  • Route2
    • Ethyl 2,3-dioxobutanoate|CS-W019008
      1723-25-7
    • ~%
    • Butane-1,2,3-triol|CS-0332229
      4435-50-1

    References

    • Adkins; Billica Journal of the American Chemical Society, 1948 , vol. 70, p. 3121
  • Route3
    • (3-Methyloxiran-2-yl)methanol|CS-0355118
      872-38-8
    • ~96%
    • Butane-1,2,3-triol|CS-0332229
      4435-50-1

    References

    • Wang, Zhi; Cui, Yong-Tao; Xu, Zhao-Bing; Qu, Jin Journal of Organic Chemistry, 2008 , vol. 73, # 6 p. 2270 - 2274

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

Quality Control

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Computational Chemistry Data

  • TPSA   60.69
  • LogP   -1.2796
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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