chempirical

Disodium creatine phosphate

C4H8N3Na2O5PCAS 922-32-7255.08 g/mol

Open in Covalent MOL file
NO−ONHNHPO−OOHNa+Na+
Carboxylic acidGuanidine

Properties

Molecular formula
C4H8N3Na2O5P
Molar mass
255.08 g/mol
Exact mass
254.9997 Da
logP
-2.14Crippen estimate
Polar surface area
133.9 Ų
H-bond donors / acceptors
5 / 3
Rotatable bonds
3

Identifiers

CAS number
922-32-7
SMILES
CN(CC([O-])=O)C(=N)NP([O-])(=O)O.[Na+].[Na+]
InChIKey
SLKASYREERFQJJ-UHFFFAOYSA-N
InChI
InChI=1S/C4H10N3O5P.2Na/c1-7(2-3(8)9)4(5)6-13(10,11)12;;/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12);;

Weigh it out

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

Names and synonyms

7 names
  • Glycine, N-[imino(phosphonoamino)methyl]-N-methyl-, sodium salt (1:2)
  • Sarcosine, N-(phosphonoamidino)-, disodium salt
  • Glycine, N-[imino(phosphonoamino)methyl]-N-methyl-, disodium salt
  • Disodium phosphocreatine
  • Phosphocreatine disodium
  • Disodium [N′-(carboxymethyl)-N′-methylcarbamimidamido]phosphonate
  • Disodium 2-[methyl-(N′-phosphonatocarbamimidoyl)amino]acetic acid

Work with Disodium creatine phosphate

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

Similar compounds

Phosphocreatine67-07-246 % similar Sodium lauroyl sarcosinate137-16-641 % similar Disodium nitrilotriacetate15467-20-637 % similar Trisodium nitrilotriacetate5064-31-337 % similar Magnesium disodium edta14402-88-136 % similar Calcium disodium edta62-33-936 % similar Disodium ethylenediaminetetraacetate139-33-335 % similar Trisodium edta150-38-935 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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