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CS-W001157 4
Total: USD 88.00

1-(3-Chloropropoxy)-3-methylbenzene

  • CAS No. 62806-87-5

  • Cat. No. CS-0116907
  • Purity≥98%
  • MDL No.None

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

1-(3-Chloropropoxy)-3-methylbenzene|CS-0116907

Structure of 62806-87-5

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General Information

  • CAS No. 62806-87-5
  • Cat. No. CS-0116907
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃ClO
  • Molecular Weight 184.66
  • Synonym(s) Benzene,1-(3-chloropropoxy)-3-methyl
  • SMILES CC1=CC(OCCCCl)=CC=C1

Synthesis

  • Route1
    • null|null
      108-39-4
    • null|null
      109-70-6
    • ~79%
    • 1-(3-Chloropropoxy)-3-methylbenzene|CS-0116907
      62806-87-5

    References

    • Walsh, David A.; Franzyshen, Stephen K.; Yanni, John M. Journal of Medicinal Chemistry, 1989 , vol. 32, # 1 p. 105 - 118
  • Route2
    • null|null
      108-39-4
    • null|null
      109-70-6
    • ~%
    • 1-(3-Bromopropoxy)-3-methylbenzene|CS-1690653
      6291-74-3
    • 1-(3-Chloropropoxy)-3-methylbenzene|CS-0116907
      62806-87-5

    References

    • Reinholz; Becker; Hagenbruch; Schafer; Schmitt Synthesis, 1990 , # 11 p. 1069 - 1071

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   9.23
  • LogP   3.00272
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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