Cas no 1311200-05-1 (Tert-butyl 4-amino-2-(trifluoromethyl)benzoate)

Tert-butyl 4-amino-2-(trifluoromethyl)benzoate structure
1311200-05-1 structure
Product Name:Tert-butyl 4-amino-2-(trifluoromethyl)benzoate
CAS No:1311200-05-1
MF:C12H14F3NO2
MW:261.240273952484
MDL:MFCD08703395
CID:2181757
PubChem ID:70247785
Update Time:2024-11-04

Tert-butyl 4-amino-2-(trifluoromethyl)benzoate Chemical and Physical Properties

Names and Identifiers

    • Tert-butyl 4-amino-2-(trifluoromethyl)benzoate
    • AK431035
    • AX8271572
    • O12133
    • 1311200-05-1
    • DB-233926
    • CLJQXSMSVHCCST-UHFFFAOYSA-N
    • DS-18731
    • CS-0154850
    • SCHEMBL7987024
    • AKOS027393600
    • EN300-6508547
    • tert-butyl4-amino-2-(trifluoromethyl)benzoate
    • MDL： MFCD08703395
    • Inchi： 1S/C12H14F3NO2/c1-11(2,3)18-10(17)8-5-4-7(16)6-9(8)12(13,14)15/h4-6H,16H2,1-3H3
    • InChI Key： CLJQXSMSVHCCST-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(C=CC=1C(=O)OC(C)(C)C)N)(F)F

Computed Properties

  • Exact Mass: 261.09766318g/mol
  • Monoisotopic Mass: 261.09766318g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 309
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 52.3
  • XLogP3: 3

Tert-butyl 4-amino-2-(trifluoromethyl)benzoate Security Information

Tert-butyl 4-amino-2-(trifluoromethyl)benzoate Pricemore >>

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