Cas no 125568-74-3 (Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI))

Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI) structure
125568-74-3 structure
Product Name:Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI)
CAS No:125568-74-3
MF:C8H6F3NO2
MW:205.133952617645
CID:877663
Update Time:2025-04-19

Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI) Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI)
    • Inchi: 1S/C8H6F3NO2/c1-14-8(13)5-3(9)2-4(10)7(12)6(5)11/h2H,12H2,1H3
    • InChI Key: NPLVVMLTRUVJGJ-UHFFFAOYSA-N
    • SMILES: C(OC)(=O)C1=C(F)C=C(F)C(N)=C1F

Computed Properties

  • Exact Mass: 205.03508

Experimental Properties

  • PSA: 52.32

Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI) Production Method

Production Method 1

Reaction Conditions
Reference
Descriptive photochemistry of polyfluorinated azide derivatives of methyl benzoate
Soundararajan, N.; Platz, Matthew S., Journal of Organic Chemistry, 1990, 55(7), 2034-44

Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI) Raw materials

Benzoic acid, 3-amino-2,4,6-trifluoro-, methyl ester (9CI) Preparation Products

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