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CS-W001157 4
Total: USD 88.00

3-Methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline

  • CAS No. 958245-18-6

  • Cat. No. CS-B0291
  • Purity≥98%
  • MDL No.MFCD11870475

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

3-Methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline|CS-B0291

Structure of 958245-18-6

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General Information

  • CAS No. 958245-18-6
  • Cat. No. CS-B0291
  • Purity ≥98%
  • MDL No. MFCD11870475
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃N₃O
  • Molecular Weight 203.24
  • Synonym(s) 3-methoxy-4-(4-methyl-1H-imidazol-1-yl)benzenamine
  • SMILES NC1=CC=C(C(OC)=C1)N2C=NC(C)=C2

Synthesis

  • Route1

    References

    • BRISTOL-MYERS SQUIBB COMPANY; BOY, Kenneth M.; GUERNON, Jason M.; MACOR, John E.; OLSON, Richard E.; SHI, Jianliang; THOMPSON, III, Lorin A.; WU, Yong-Jin; XU, Li; ZHANG, Yunhui; ZUEV, Dmitry S. Patent: WO2011/14535 A1, 2011 ; Location in patent: Page/Page column 44-45 ; WO 2011/014535 A1
  • Route2

    References

    • WO2011/6903 A1, ; WO 2011/006903 A1
  • Route3

    References

    • WO2011/14535 A1, ; WO 2011/014535 A1

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   53.07
  • LogP   1.77152
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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