chempirical

Calcium oxalate (1:1)

C2CaO4CAS 563-72-4128.10 g/mol

Open in Covalent MOL file
O−OO−OCa2+
Carboxylic acid

Properties

Molecular formula
C2CaO4
Molar mass
128.10 g/mol
Exact mass
127.9422 Da
logP
-1.23Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
563-72-4
SMILES
[O-]C(=O)C([O-])=O.[Ca+2]
InChIKey
XJHLJVVLRQXMQI-UHFFFAOYSA-N
InChI
InChI=1S/C2H2O4.Ca/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);

Weigh it out

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

Names and synonyms

2 names
  • Ethanedioic acid, calcium salt (1:1)
  • Oxalic acid, calcium salt (1:1)

Work with Calcium oxalate (1:1)

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

Caesium oxalate1068-63-960 % similar Europium(III) oxalate3269-12-360 % similar Barium oxalate516-02-960 % similar Iron(II) oxalate516-03-060 % similar Silver oxalate533-51-760 % similar Lithium oxalate553-91-360 % similar Dipotassium oxalate583-52-860 % similar Sodium oxalate62-76-060 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia