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CS-W001157 4
Total: USD 88.00

Isobutyl (E)-2-methylbut-2-enoate

  • CAS No. 61692-84-0

  • Cat. No. CS-0454224
  • Molecule weight156.22
  • Purity≥98%
  • MDL No.None

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

Isobutyl (E)-2-methylbut-2-enoate|CS-0454224

Structure of 61692-84-0

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General Information

  • CAS No. 61692-84-0
  • Cat. No. CS-0454224
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₂
  • Molecular Weight 156.22
  • Synonym(s) Tiglic Acid Isobutyl Ester (stabilized with HQ)
  • SMILES C/C=C(\C)/C(=O)OCC(C)C

Synthesis

  • Route1
    • null|null
      876510-33-7
    • ~%
    • Isobutyl (E)-2-methylbut-2-enoate|CS-0454224
      61692-84-0

    References

    • Journal of the American Chemical Society, , vol. 70, p. 1157
  • Route2
    • null|null
      15811-72-0
    • ~%
    • Isobutyl (E)-2-methylbut-2-enoate|CS-0454224
      61692-84-0

    References

    • Journal of the American Chemical Society, , vol. 70, p. 1157
  • Route3
    • null|null
      876510-34-8
    • ~%
    • Isobutyl (E)-2-methylbut-2-enoate|CS-0454224
      61692-84-0

    References

    • Journal of the American Chemical Society, , vol. 70, p. 1157

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Danger
UN#: 3272
Class : 3
Packing Group : Ⅲ
Hazard Statements : H225
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.1518
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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