Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Tiludronate disodium hemihydrate
RN: 155453-10-4
UNII: 39SMX0W5WK
InChIKey: KDVKAYPVWJFARG-UHFFFAOYSA-J

Molecular Formula

  • 2C7-H7-Cl-O6-P2-S.4Na.H2-O

Molecular Weight

  • 743.1614
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Tiludronate disodium hemihydrate

Synonyms

  • P,P'-(((4-Chlorophenyl)thio)methylene)bisphosphonic acid, disodium hemihydrate
  • Phosphonic acid, (((4-chlorophenyl)thio)methylene)bis-, disodium salt, hydrate (2:1)
  • Tiludronate disodium hemihydrate
  • Tiludronic acid disodium salt hemihydrate [MI]
  • UNII-39SMX0W5WK

Registry Numbers

CAS Registry Number

  • 155453-10-4

FDA UNII

  • 39SMX0W5WK

System Generated Number

  • 0155453104

Structure Descriptors

InChI

1S/2C7H9ClO6P2S.4Na.H2O/c2*8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14;;;;;/h2*1-4,7H,(H2,9,10,11)(H2,12,13,14);;;;;1H2/q;;4*+1;/p-4

InChIKey

KDVKAYPVWJFARG-UHFFFAOYSA-J

Smiles

c1cc(ccc1SC(P(=O)(O)[O-])P(=O)(O)[O-])Cl.c1cc(ccc1SC(P(=O)(O)[O-])P(=O)(O)[O-])Cl.O.[Na+].[Na+].[Na+].[Na+]