CHEBI:4496 - calcium hydrogenphosphate dihydrate

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ChEBI Name calcium hydrogenphosphate dihydrate
ChEBI ID CHEBI:4496
Stars This entity has been manually annotated by the ChEBI Team.
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Formulae CaH5O6P
HO4P.2H2O.Ca
Net Charge 0
Average Mass 172.08786
Monoisotopic Mass 171.945
InChI InChI=1S/Ca.H3O4P.2H2O/c;1-5(2,3)4;;/h;(H3,1,2,3,4);2*1H2/q+2;;;/p-2
InChIKey XAAHAAMILDNBPS-UHFFFAOYSA-L
SMILES [Ca++].[H]O[H].[H]O[H].[H]OP([O-])([O-])=O
ChEBI Ontology
Outgoing 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 Sources
CaHPO4·2H2O IUPAC
calcium monohydrogen phosphate dihydrate ChemIDplus
Dibasic calcium phosphate KEGG COMPOUND
Dibasic calcium phosphate dihydrate KEGG COMPOUND
phosphoric acid, calcium salt (1:1), dihydrate ChemIDplus
Database Link Database
D00937 KEGG DRUG
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Registry Number Type Source
7789-77-7 CAS Registry Number ChemIDplus
Last Modified
28 July 2014