Sodium citrate dihydrate

C6H9Na3O9CAS 6132-04-3294.10 g/mol

Open in Covalent MOL file
O−OOHO−OO−OH2OH2ONa+Na+Na+
AlcoholCarboxylic acid

Properties

Molecular formula
C6H9Na3O9
Molar mass
294.10 g/mol
Exact mass
293.9940 Da
Melting point
150 °C (decomposes)
logP
-4.04Crippen estimate
Polar surface area
195.1 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
5

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
6132-04-3
SMILES
[O-]C(=O)CC(O)(CC([O-])=O)C([O-])=O.O.O.[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

5 names
  • 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt, hydrate (1:3:2)
  • Citric acid, trisodium salt, dihydrate
  • 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate
  • Trisodium citrate dihydrate
  • N 1560

Work with Sodium citrate dihydrate

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.

2-Hydroxy-1,2,3-propanetricarboxylic acid hydrate (1:1)5949-29-1Hydrate Trisodium citrate68-04-2Anhydrous Citric acid77-92-9Free acid Potassium citrate866-84-2Salt Calcium citrate813-94-5Salt Ammonium ferric citrate1185-57-5Salt Disodium citrate144-33-2Salt Monosodium citrate18996-35-5Salt Piperazine citrate144-29-6Salt Triammonium citrate3458-72-8Salt Aluminium citrate31142-56-0Salt Clostilbegit50-41-9Salt

Similar compounds

Calcium citrate malate142606-53-950 % similar Disodium propanedioate hydrate26522-85-048 % similar Sodium succinate hexahydrate6106-21-448 % similar Sodium iminodiacetate dibasic monohydrate17593-73-644 % similar Trisodium nitrilotriacetate monohydrate18662-53-844 % similar Tetrasodium ethylenediaminetetraacetate dihydrate10378-23-142 % similar Ethylenediaminetetraacetic acid tetrasodium salt tetrahydrate13235-36-442 % similar Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, tetrasodium salt, trihydrate67401-50-742 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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