5-[(Butoxymethyl)Sulfamoyl]-4-Chloro-2-[(2-Furylmethyl)Amino]Benzoic Acid

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Formula C17H21ClN2O6S
IUPAC Name 5-(butoxymethylsulfamoyl)-4-chloro-2-(2-furylmethylamino)benzoic acid
Molecular Mass 416.876 g·mol−1
Heat of Formation -953.3 ± 16.7 kJ·mol−1
Dipole Moment 7.06 ± 1.08 D
Volume 452.39 Å 3
Surface Area 360.21 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(butoxymethylsulfamoyl)-4-chloro-2-(furan-2-ylmethylamino)benzoic acid
  • benzoic acid, 5-(((butoxymethyl)amino)sulfonyl)-4-chloro-2-((2-furanylmethyl)amino)-
  • butoxymethylene furosemide
  • ffbu
CAS Number(s)
  • 40532-27-2
InChIKey JBCBWDYSSJINSH-UHFFFAOYSA-N
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