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CHEBI:4496 - calcium hydrogenphosphate dihydrate

ChEBI IDCHEBI:4496
ChEBI Namecalcium hydrogenphosphate dihydrate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaCa.2H2O.HO4P
Net Charge0
Average Mass172.086
Monoisotopic Mass171.94497
SMILES[Ca+2].[H]OP(=O)([O-])[O-].[H]O[H].[H]O[H]
InChIInChI=1S/Ca.H3O4P.2H2O/c;1-5(2,3)4;;/h;(H3,1,2,3,4);2*1H2/q+2;;;/p-2
InChIKeyXAAHAAMILDNBPS-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
calcium hydrogenphosphate dihydrate (CHEBI:4496) is a calcium salt (CHEBI:35156)
calcium hydrogenphosphate dihydrate (CHEBI:4496) is a hydrate (CHEBI:35505)
IUPAC Name 
calcium hydrogenphosphate—water (1/2)
Synonyms  Source
Dibasic calcium phosphate dihydrateKEGG COMPOUND
CaHPO4·2H2OIUPAC
calcium monohydrogen phosphate dihydrateChemIDplus
phosphoric acid, calcium salt (1:1), dihydrateChemIDplus
Dibasic calcium phosphateKEGG COMPOUND
Manual XrefsDatabases
D00937KEGG DRUG
Registry NumbersSources
CAS:7789-77-7KEGG COMPOUND
CAS:7789-77-7ChemIDplus