Calcium citrate

tricalcium bis(2-hydroxypropane-1,2,3-tricarboxylate)

CAS: 813-94-5

Molecular Formula	`C12H10Ca3O14`
Molecular Weight	498.4 g/mol
Topological Polar Surface Area	281.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	14
Rotatable Bonds	4
Exact Mass	497.89484
Heavy Atoms	29
Complexity	211.0

Chemical Identifiers

CAS Number	813-94-5
SMILES	`C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ca+2].[Ca+2].[Ca+2]`
InChIKey	`FNAQSUUGMSOBHW-UHFFFAOYSA-H`

📖 Product Overview

Calcium citrate (CAS: 813-94-5) is a chemical compound with molecular formula C12H10Ca3O14 and molecular weight 498.4 g/mol. Its IUPAC systematic name is tricalcium bis(2-hydroxypropane-1,2,3-tricarboxylate). Topological Polar Surface Area 281.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 14 Rotatable Bonds 4 Exact Mass 497.89484 Heavy Atoms 29 Complexity 211.0 InChI Key: FNAQSUUGMSOBHW-UHFFFAOYSA-H. SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ca+2].[Ca+2].[Ca+2].

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