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CS-W001157 4
Total: USD 88.00

2-Ethyl-2-methyl-1,3-propanediol

  • CAS No. 77-84-9

  • Cat. No. CS-0207422
  • Molecule weight118.17
  • Purity98+%
  • MDL No.MFCD00004693

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

2-Ethyl-2-methyl-1,3-propanediol|CS-0207422

Structure of 77-84-9

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General Information

  • CAS No. 77-84-9
  • Cat. No. CS-0207422
  • Purity 98+%
  • MDL No. MFCD00004693
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₄O₂
  • Molecular Weight 118.17
  • Synonym(s) 2,2-Bis(hydroxymethyl)butane
  • SMILES CCC(C)(CO)CO

Synthesis

  • Route1
    • Diethyl 2-ethyl-2-methylmalonate|CS-0320717
      2049-70-9
    • ~94%
    • 2-Ethyl-2-methyl-1,3-propanediol|CS-0207422
      77-84-9

    References

    • Lee, Hyun Soo; Kim, Dong H. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 22 p. 4685 - 4691
  • Route2
    • null|null
      1629-58-9
    • ~0%
    • null|null
      137-32-6
    • 2-Ethyl-2-methyl-1,3-propanediol|CS-0207422
      77-84-9

    References

    • Bayer Aktiengesellschaft Patent: US4097540 A1, 1978 ;
  • Route3
    • null|null
      1629-58-9
    • ~0%
    • null|null
      6032-29-7
    • 2-Ethyl-2-methyl-1,3-propanediol|CS-0207422
      77-84-9

    References

    • Bayer Aktiengesellschaft Patent: US4097540 A1, 1978 ;

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   0.3873
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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