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CS-W001157 4
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3-Amino-5-fluoro-2-methylbenzoic acid

  • CAS No. 246877-31-6

  • Cat. No. CS-0370488
  • Molecule weight169.15
  • Purity95+%
  • MDL No.None

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

3-Amino-5-fluoro-2-methylbenzoic acid|CS-0370488

Structure of 246877-31-6

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General Information

  • CAS No. 246877-31-6
  • Cat. No. CS-0370488
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈FNO₂
  • Molecular Weight 169.15
  • Synonym(s) 3-amino-5-ethoxy-1,2,4-oxadiazole
  • SMILES O=C(O)C1=CC(F)=CC(N)=C1C

Synthesis

  • Route1

    References

    • ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. Patent: WO2009/112832 A1, 2009 ; Location in patent: Page/Page column 60-61 ;
  • Route2
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      246877-30-5
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    • 3-Amino-5-fluoro-2-methylbenzoic acid|CS-0370488
      246877-31-6

    References

    • Takashiro, Eiji; Hayakawa, Ichiro; Nitta, Tamayo; Kasuya, Atsushi; Miyamoto, Shuichi; Ozawa, Yuji; Yagi, Ryuichi; Yamamoto, Ikue; Shibayama, Takahiro; Nakagawa, Akihiko; Yabe, Yuichiro Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 9 p. 2063 - 2072
  • Route3

    References

    • Takashiro, Eiji; Hayakawa, Ichiro; Nitta, Tamayo; Kasuya, Atsushi; Miyamoto, Shuichi; Ozawa, Yuji; Yagi, Ryuichi; Yamamoto, Ikue; Shibayama, Takahiro; Nakagawa, Akihiko; Yabe, Yuichiro Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 9 p. 2063 - 2072

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.32
  • LogP   1.41452
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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