chempirical

Sodium carbonate monohydrate

CH2Na2O4CAS 5968-11-6124.00 g/mol

Open in Covalent MOL file
OO−O−H2ONa+Na+

Properties

Molecular formula
CH2Na2O4
Molar mass
124.00 g/mol
Exact mass
123.9748 Da
logP
-9.26Crippen estimate
Polar surface area
94.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
5968-11-6
SMILES
C(=O)([O-])[O-].O.[Na+].[Na+]
InChIKey
MQRJBSHKWOFOGF-UHFFFAOYSA-L
InChI
InChI=1S/CH2O3.2Na.H2O/c2-1(3)4;;;/h(H2,2,3,4);;;1H2/q;2*+1;/p-2

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Names and synonyms

1 names
  • Sodium carbonate, monohydrate

Work with Sodium carbonate monohydrate

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.

Sodium carbonate decahydrate6132-02-1Hydrate Sodium carbonate497-19-8Anhydrous Sodium bicarbonate144-55-8Salt Potassium carbonate584-08-7Salt Sodium percarbonate15630-89-4Salt Calcium carbonate471-34-1Salt Magnesium carbonate546-93-0Salt Lithium carbonate554-13-2Salt White lead1319-46-6Salt Basic copper carbonate12069-69-1Salt Hydrotalcite (mg6(CO3)[al(OH)6]2(OH)4.4H2O)12304-65-3Salt Potassium bicarbonate298-14-6Salt

Similar compounds

Zirconium carbonate oxide hydrate (Zr3O5(CO3).H2O)12671-00-057 % similar Diammonium bis(carbonato)dihydroxyzirconate(2-)68309-95-557 % similar Disodium propanedioate hydrate26522-85-050 % similar Sodium succinate hexahydrate6106-21-450 % similar Sodium acetate trihydrate6131-90-450 % similar Sodium iminodiacetate dibasic monohydrate17593-73-644 % similar Trisodium nitrilotriacetate monohydrate18662-53-844 % similar Sodium tartrate dihydrate6106-24-744 % similar

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

Elsewhere

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