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CS-W001157 4
Total: USD 88.00

Ethyl 4-amino-5-(4-chloro-3-nitrobenzoyl)-2-((2-(trifluoromethyl)phenyl)amino)thiophene-3-carboxylate

  • CAS No. 680212-25-3

  • Cat. No. CS-0030035
  • Purity≥95%
  • MDL No.MFCD00206829

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

Ethyl 4-amino-5-(4-chloro-3-nitrobenzoyl)-2-((2-(trifluoromethyl)phenyl)amino)thiophene-3-carboxylate|CS-0030035

Structure of 680212-25-3

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General Information

  • CAS No. 680212-25-3
  • Cat. No. CS-0030035
  • Purity ≥95%
  • MDL No. MFCD00206829
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₁H₁₅ClF₃N₃O₅S
  • Molecular Weight 513.87
  • Synonym(s) 3-Thiophenecarboxylic acid, 4-amino-5-(4-chloro-3-nitrobenzoyl)-2-[[2-(trifluoromethyl)phenyl]amino]-, ethyl ester
  • SMILES CCOC(C(C(N)=C(C(C1=CC([N+]([O-])=O)=C(Cl)C=C1)=O)S2)=C2NC3=C(C=CC=C3)C(F)(F)F)=O

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312+H332-H315-H319-H335
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   124.56
  • LogP   6.062
  • H_Acceptors   8
  • H_Donors   2
  • Rotatable_Bonds   7

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