Probenecid

CAS Registry Number®

57-66-9
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CAS Name

Probenecid

Molecular Formula

C13H19NO4S

Molecular Mass

285.36

Cite this Page

Probenecid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57-66-9 (retrieved 2024-07-12) (CAS RN: 57-66-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    194-196 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16)

InChIKey

InChIKey=DBABZHXKTCFAPX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-[(dipropylamino)sulfonyl]-
  • Benzoic acid, p-(dipropylsulfamoyl)-
  • 4-[(Dipropylamino)sulfonyl]benzoic acid
  • Benemid
  • p-(Dipropylsulfamoyl)benzoic acid

Deleted or Replaced CAS Registry Numbers

1384172-26-2