3-(Aminosulfonyl)-4-fluorobenzoic acid

CAS Registry Number®

1535-45-1
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CAS Name

3-(Aminosulfonyl)-4-fluorobenzoic acid

Molecular Formula

C7H6FNO4S

Molecular Mass

219.19

Cite this Page

3-(Aminosulfonyl)-4-fluorobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1535-45-1 (retrieved 2024-04-29) (CAS RN: 1535-45-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    239-241 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H6FNO4S/c8-5-2-1-4(7(10)11)3-6(5)14(9,12)13/h1-3H,(H,10,11)(H2,9,12,13)

InChIKey

InChIKey=NGBMRUQCUCRKQN-UHFFFAOYSA-N

SMILES

S(N)(=O)(=O)C1=CC(C(O)=O)=CC=C1F

Canonical SMILES

O=C(O)C1=CC=C(F)C(=C1)S(=O)(=O)N

Other Names for this Substance

  • Benzoic acid, 3-(aminosulfonyl)-4-fluoro-
  • Benzoic acid, 4-fluoro-3-sulfamoyl-
  • 3-(Aminosulfonyl)-4-fluorobenzoic acid
  • 4-Fluoro-3-sulfamoylbenzoic acid

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