Alendronic acid monohydrate

CAS Registry Number®

138624-11-0

CAS Name

Alendronic acid monohydrate

Molecular Formula

C4H13NO7P2.H2O

Cite this Page

Alendronic acid monohydrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=138624-11-0 (retrieved 2024-11-22) (CAS RN: 138624-11-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C4H13NO7P2.H2O/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);1H2

InChIKey

InChIKey=AQAZLLYAEFBJMU-UHFFFAOYSA-N

SMILES

C(P(=O)(O)O)(P(=O)(O)O)(CCCN)O.O

Canonical SMILES

O=P(O)(O)C(O)(CCCN)P(=O)(O)O.O

Other Names for this Substance

  • Phosphonic acid, P,P′-(4-amino-1-hydroxybutylidene)bis-, hydrate (1:1)
  • Phosphonic acid, (4-amino-1-hydroxybutylidene)bis-, monohydrate
  • Alendronic acid monohydrate

CAS INSIGHTSTM
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