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CS-W001157 4
Total: USD 88.00

tert-Butyl 7-iodoheptanoate

  • CAS No. 54005-76-4

  • Cat. No. CS-0528619
  • Purity≥97%
  • MDL No.MFCD32642825

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

tert-Butyl 7-iodoheptanoate|CS-0528619

Structure of 54005-76-4

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General Information

  • CAS No. 54005-76-4
  • Cat. No. CS-0528619
  • Purity ≥97%
  • MDL No. MFCD32642825
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₁IO₂
  • Molecular Weight 312.19
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)CCCCCCI

Synthesis

  • Route1

    References

    • Marino; Kelly Journal of Organic Chemistry, 1981 , vol. 46, # 22 p. 4389 - 4393
  • Route2
    • 7-Iodoheptanoic acid|CS-1329368
      88019-89-0
    • null|null
      115-11-7
    • ~54%
    • In-stock
      tert-Butyl 7-iodoheptanoate|CS-0528619
      54005-76-4

    References

    • Neu, Henrik; Kihlberg, Tor; Langstroem, Bengt Journal of Labelled Compounds and Radiopharmaceuticals, 1997 , vol. 39, # 6 p. 509 - 524
  • Route3
    • null|null
      111-24-0
    • ~%
    • In-stock
      tert-Butyl 7-iodoheptanoate|CS-0528619
      54005-76-4

    References

    • Marino; Kelly Journal of Organic Chemistry, 1981 , vol. 46, # 22 p. 4389 - 4393

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2810
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.7136
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   6

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