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CHEBI:32583 - calcium sulfate dihydrate

ChEBI IDCHEBI:32583
ChEBI Namecalcium sulfate dihydrate
Stars
Last Modified12 March 2008
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaCa.2H2O.O4S
Net Charge0
Average Mass172.171
Monoisotopic Mass171.93545
SMILESO=S(=O)([O-])[O-].[Ca+2].[H]O[H].[H]O[H]
InChIInChI=1S/Ca.H2O4S.2H2O/c;1-5(2,3)4;;/h;(H2,1,2,3,4);2*1H2/q+2;;;/p-2
InChIKeyPASHVRUKOFIRIK-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
calcium sulfate dihydrate (CHEBI:32583) has part calcium sulfate (CHEBI:31346)
calcium sulfate dihydrate (CHEBI:32583) is a calcium salt (CHEBI:35156)
calcium sulfate dihydrate (CHEBI:32583) is a hydrate (CHEBI:35505)
Incoming Relation(s)
gypsum (CHEBI:48838) is a calcium sulfate dihydrate (CHEBI:32583)
IUPAC Name 
calcium sulfate—water (1/2)
Synonyms  Source
calcium(II) sulfate, dihydrate (1:1:2)ChemIDplus
calcium sulfate dihydrateIUPAC
CaSO4·2H2OIUPAC
sulfuric acid, calcium(2+) salt, dihydrateChemIDplus
sulfuric acid, calcium salt (1:1), dihydrateChemIDplus
Manual XrefsDatabases
1318PPDB
Registry NumbersSources
Gmelin:7487Gmelin
CAS:10101-41-4ChemIDplus