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CS-W001157 4
Total: USD 88.00

2-Isopropyl-1-methoxy-4-nitrobenzene

  • CAS No. 1706-81-6

  • Cat. No. CS-0582749
  • Purity≥98%
  • MDL No.None

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

2-Isopropyl-1-methoxy-4-nitrobenzene|CS-0582749

Structure of 1706-81-6

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General Information

  • CAS No. 1706-81-6
  • Cat. No. CS-0582749
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃NO₃
  • Molecular Weight 195.22
  • Synonym(s) 5-NITRO-2-METHOXY-1-ISOPROPYLBEZOL
  • SMILES CC(C)C1=C(C=CC(=C1)[N+](=O)[O-])OC

Synthesis

  • Route1

    References

    • Roche Palo Alto LLC Patent: US2007/49610 A1, 2007 ; Location in patent: Page/Page column 25 ;
  • Route2

    References

    • Chang; Chui; Tan; Yang; Zhong; Lee; Sham; Wong Journal of Medicinal Chemistry, 1991 , vol. 34, # 5 p. 1675 - 1692

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   52.37
  • LogP   2.7268
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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