ChemicalBook--->CAS DataBase List--->89987-06-4

89987-06-4

89987-06-4 Structure

89987-06-4 Structure
IdentificationBack Directory
[Name]

Tiludronic acid
[CAS]

89987-06-4
[Synonyms]

ACPMD
C08141
C1-TMBP
ME-3737
Tiludronic
TILUDRONIC ACID
Tilundronic Acid
Tiludronic acid disodium
Tiludronate disodium salt hydrate
(4-Chlorophenylthio)methylenediphosphonic acid
[[(4-Chlorophenyl)thio]methylene]bisphosphonic acid
[[(4-Chlorophenyl)thio]methylene]bisphosphonic acid disodium salt hydrate
[Molecular Formula]

C7H9ClO6P2S
[MDL Number]

MFCD00867070
[MOL File]

89987-06-4.mol
[Molecular Weight]

318.61
Chemical PropertiesBack Directory
[Melting point ]

174-177 °C
[Boiling point ]

600.7±65.0 °C(Predicted)
[density ]

1.82±0.1 g/cm3(Predicted)
[storage temp. ]

room temp
[solubility ]

H2O: >10mg/mL, clear
[form ]

powder
[pka]

pK1 10.85; pK2 6.90; pK3 2.95; pK4 1.30(at 25℃)
[color ]

white to off-white
[Water Solubility ]

H2O: >10mg/mL, clear
[InChI]

1S/C7H9ClO6P2S.2Na.H2O/c8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14;;;/h1-4,7H,(H2,9,10,11)(H2,12,13,14);;;1H2/q;2*+1;/p-2
[InChIKey]

SZVJRJRMQCKFON-UHFFFAOYSA-L
[SMILES]

O.[Na+].[Na+].OP([O-])(=O)C(Sc1ccc(Cl)cc1)P(O)([O-])=O
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Molybdenum disulfide-->METHYLENEDIPHOSPHONIC ACID
Hazard InformationBack Directory
[Chemical Properties]

pKl 10.85; pK2 6.90; pK3 2.95; pKa 41.30. Tiludronic Acid Di-tert-butylamine Salt: melting point 253°C (decomposition).
[Definition]

ChEBI: Tiludronic acid is an organochlorine compound.
[Biological Activity]

Tiludronate is a bisphosphonate bone resorption inhibitor. Tiludronate inhibits protein-tyrosine-phosphataseleading to detachment of osteoclasts from the bone surface. It also inhibits the osteoclastic proton pump and is used to tre at Pagetμs disease.
[Veterinary Drugs and Treatments]

Tiludronate disodium (tiludronic acid) is a bisphosphonate bone resorption inhibitor that is available in some countries for the intravenous treatment of navicular disease in horses. Treatment earlier in the course of the disease apparently results in greater efficacy.
For humans, there is an orally administered FDA-approved product for treating Paget’s disease (osteitis deformans).
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