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CS-W001157 4
Total: USD 88.00

(3S,6S)-3,6-Octanediol

  • CAS No. 136705-66-3

  • Cat. No. CS-0109384
  • Purity≥97%
  • MDL No.None

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

(3S,6S)-3,6-Octanediol|CS-0109384

Structure of 136705-66-3

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General Information

  • CAS No. 136705-66-3
  • Cat. No. CS-0109384
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₈O₂
  • Molecular Weight 146.23
  • Synonym(s) 3,​6-​Octanediol, (3S,​6S)​-
  • SMILES CC[C@H](O)CC[C@@H](O)CC

Synthesis

  • Route1
    • null|null
      219576-38-2
    • ~%
    • (3S,6S)-3,6-Octanediol|CS-0109384
      136705-66-3

    References

    • Bach, Jordi; Berenguer, Ramon; Garcia, Jordi; Lopez, Marta; Manzanal, Judith; Vilarrasa, Jaume Tetrahedron, 1998 , vol. 54, # 49 p. 14947 - 14962
  • Route2
    • 2,5-Diethylfuran|CS-0685158
      10504-06-0
    • ~%
    • (3S,6S)-3,6-Octanediol|CS-0109384
      136705-66-3

    References

    • Bach, Jordi; Berenguer, Ramon; Garcia, Jordi; Lopez, Marta; Manzanal, Judith; Vilarrasa, Jaume Tetrahedron, 1998 , vol. 54, # 49 p. 14947 - 14962
  • Route3
    • null|null
      101567-53-7
    • ~%
    • (3S,6S)-3,6-Octanediol|CS-0109384
      136705-66-3

    References

    • Bach, Jordi; Berenguer, Ramon; Garcia, Jordi; Lopez, Marta; Manzanal, Judith; Vilarrasa, Jaume Tetrahedron, 1998 , vol. 54, # 49 p. 14947 - 14962

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   40.46
  • LogP   1.3084
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   5

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