Monocalcium phosphate

CaH4O8P2CAS 7758-23-8234.05 g/mol

Open in Covalent MOL file
O−PO−OHOOPOHOHHOCa2+
Phosphate

Properties

Molecular formula
CaH4O8P2
Molar mass
234.05 g/mol
Exact mass
233.9007 Da
Density
2.22 g/mL (at 18 °C)
logP
-1.31Crippen estimate
Polar surface area
77.8 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
7758-23-8
SMILES
[O-]P([O-])(=O)O.O=P(O)(O)O.[Ca+2]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

31 names · show all
  • Phosphoric acid, calcium salt (2:1)
  • Acid calcium phosphate
  • Calcium phosphate monobasic
  • Calcium monobasic phosphate
  • Calcium dihydrogen phosphate
  • Calcium hydrogen phosphate (CaH4(PO4)2)
  • Calcium phosphate (CaH4(PO4)2)
  • Calcium tetrahydrogen orthophosphate
  • Monocalcium phosphate [CaH4(PO4)2]
  • Calcium tetrahydrogen phosphate
  • Calcium superphosphate
  • Calcium primary phosphate
  • Calcium bis(dihydrogen phosphate)
  • Calcium biphosphate
  • Calcium dihydrogen orthophosphate
  • Calcium bis(orthophosphate)
  • Monocalcium dihydrogen phosphate
  • Calcium diorthophosphate
  • Monocalcium phosphate (Ca(H2PO4)2)
  • Calcium phosphate (1:2)
  • Calcium phosphate (Ca(H2PO4)2)
  • Monobasic calcium phosphate
  • Calcium phosphate, primary
  • Calcium hydrogen phosphate (Ca(H2PO4)2)
  • V 90
  • C 38 (Phosphate)
  • C 38
  • Monocalcium orthophosphate
  • Calcium orthophosphate monobasic
  • HT monocalcium phosphate
  • Fabutit 313

Work with Monocalcium phosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tricalcium phosphate7758-87-4 Dicalcium phosphate7757-93-9 Dynafos10103-46-5

Similar compounds

Monocalcium phosphate monohydrate10031-30-886 % similar Monomagnesium phosphate13092-66-573 % similar Barium phosphate (Ba(H2PO4)2)13466-20-173 % similar Zinc dihydrogen phosphate13598-37-373 % similar Manganese dihydrogen phosphate18718-07-573 % similar Calcium hydrogen phosphate dihydrate7789-77-768 % similar Barium phosphate (BaHPO4)10048-98-355 % similar Strontium hydrogen phosphate13450-99-255 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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