Tetrasodium etidronate

C2H4Na4O7P2CAS 3794-83-0293.95 g/mol

Open in Covalent MOL file
OHPO−O−OPO−O−ONa+Na+Na+Na+
AlcoholPhosphonate

Properties

Molecular formula
C2H4Na4O7P2
Molar mass
293.95 g/mol
Exact mass
293.9023 Da
logP
-2.52Crippen estimate
Polar surface area
135.3 Ų
H-bond donors / acceptors
5 / 3
Rotatable bonds
2

Hazards

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

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Identifiers

CAS number
3794-83-0
SMILES
CC(O)(P([O-])([O-])=O)P([O-])([O-])=O.[Na+].[Na+].[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.

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Names and synonyms

25 names · show all
  • Phosphonic acid, P,P′-(1-hydroxyethylidene)bis-, sodium salt (1:4)
  • Phosphonic acid, (1-hydroxyethylidene)di-, tetrasodium salt
  • Phosphonic acid, (1-hydroxyethylidene)bis-, tetrasodium salt
  • 1-Hydroxyethane-1,1-diphosphonic acid tetrasodium salt
  • Tetrasodium 1-hydroxy-1,1-ethanediphosphonate
  • Tetrasodium (1-hydroxyethylidene)bis[phosphonate]
  • Dequest 2016
  • Sequion 10na4
  • Tarpinel 4NL
  • Turpinal 4NL
  • Defloc EN 43
  • 1-Hydroxyethylidene-1,1-diphosphonic acid tetrasodium salt
  • SHEDN
  • DQ 2016
  • Tetrasodium (1-hydroxyethylidene)diphosphonate
  • Encap 81105
  • (Hydroxyethylidene)diphosphonic acid tetrasodium salt
  • Briquest ADPA 21SH
  • Chelest PH 214
  • Dequest 2016D
  • Tetrasodium HEDP
  • Feliox 115A tetrasodium salt
  • Tetrasodium hydroxyethylidene-1,1-diphosphonate
  • PH 214
  • Etidronic acid Tetrasodium salt

Work with Tetrasodium etidronate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

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.

(1-Hydroxyethylidene)-1,1-diphosphonic acid2809-21-4Free acid Etidronate disodium7414-83-7Salt

Similar compounds

Clodronate sodium22560-50-541 % similar Disodium clodronate tetrahydrate88416-50-637 % similar Pamidronate disodium57248-88-137 % similar Monosodium phosphate7558-80-735 % similar Monosodium phosphate89140-32-935 % similar Disodium pamidronate pentahydrate109552-15-034 % similar Disodium phosphate7558-79-433 % similar Trisodium phosphate7601-54-932 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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