Disodium pamidronate pentahydrate

C3H19NNa2O12P2CAS 109552-15-0369.11 g/mol

NH2OHPO−O−OPOOHOHH2OH2OH2OH2OH2ONa+Na+
AlcoholPhosphonatePrimary amine

Properties

Molecular formula
C3H19NNa2O12P2
Molar mass
369.11 g/mol
Exact mass
369.0178 Da
logP
-6.55Crippen estimate
Polar surface area
318.8 Ų
H-bond donors / acceptors
6 / 4
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Identifiers

CAS number
109552-15-0
SMILES
NCCC(O)(P([O-])([O-])=O)P(=O)(O)O.O.O.O.O.O.[Na+].[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names
  • Phosphonic acid, P,P′-(3-amino-1-hydroxypropylidene)bis-, sodium salt, hydrate (1:2:5)
  • Phosphonic acid, (3-amino-1-hydroxypropylidene)bis-, disodium salt, pentahydrate

Work with Disodium pamidronate pentahydrate

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere