Barium phosphate (BaHPO4)

BaHO4PCAS 10048-98-3233.30 g/mol

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O−PO−OHOBa2+
Phosphate

Properties

Molecular formula
BaHO4P
Molar mass
233.30 g/mol
Exact mass
233.8665 Da
Density
4.7 g/mL
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
10048-98-3
SMILES
[O-]P([O-])(=O)O.[Ba+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

5 names
  • Phosphoric acid, barium salt (1:1)
  • Secondary barium phosphate
  • Barium hydrogen phosphate
  • Barium monohydrogen phosphate
  • Barium hydrogen phosphate (BaHPO4)

Work with Barium phosphate (BaHPO4)

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.

Barium phosphate (Ba(H2PO4)2)13466-20-1

Similar compounds

Dynafos10103-46-567 % similar Strontium hydrogen phosphate13450-99-267 % similar Beryllium phosphate (BeHPO4)13598-15-767 % similar Disodium phosphate7558-79-467 % similar Dicalcium phosphate7757-93-967 % similar Dipotassium phosphate7758-11-467 % similar Disodium hydrogen phosphate dihydrate10028-24-757 % similar Disodium hydrogen phosphate dodecahydrate10039-32-457 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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