CAS
82395-88-8 Purity
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82395-88-8 Purity
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Specification
PubChem CID 517068.
The molecular formula is C14H10CaO6.
The molecular weight is 314.30 g/mol.
The IUPAC Name is calcium;2-hydroxybenzoate.
The InChI is InChI=1S/2C7H6O3.Ca/c2*8-6-4-2-1-3-5(6)7(9)10;/h2*1-4,8H,(H,9,10);/q;;+2/p-2.
The InChIKey is VBIGULIJWJPALH-UHFFFAOYSA-L.
The Canonical SMILES is C1=CC=C(C(=C1)C(=O)[O-])O.C1=CC=C(C(=C1)C(=O)[O-])O.[Ca+2].
The CAS number is 824-35-1.
The European Community (EC) Number is 212-525-4.
The Monoisotopic Mass is 314.0103289 g/mol.