Bondronat

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Properties Simple | Detailed

Formula C9H23NO7P2
IUPAC Name [1-hydroxy-3-[methyl(pentyl)amino]-1-phosphono-propyl]phosphonic acid
Molecular Mass 319.229 g·mol−1
Heat of Formation -1821.8 ± 16.7 kJ·mol−1
Dipole Moment 1.04 ± 1.08 D
Volume 371.36 Å 3
Surface Area 317.46 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • (1-hydroxy-3-(methylpentylamino)propylidene)diphosphonic acid
  • [1-hydroxy-3-(methyl-pentyl-amino)-1-phosphono-propyl]-phosphonic acid
  • [1-hydroxy-3-(methyl-pentyl-amino)-1-phosphono-propyl]phosphonic acid
  • [3-(amyl-methyl-amino)-1-hydroxy-1-phosphono-propyl]phosphonic acid
  • bfq
  • ibandronate
  • ibandronic acid
  • ibandronic acid [ban:inn]
  • phosphonic acid, (1-hydroxy-3-(methylpentylamino)propylidene)bis-
  • phosphonic acid, [1-hydroxy-3-(methylpentylamino)propylidene]bis-
InChIKey MPBVHIBUJCELCL-UHFFFAOYSA-N
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