calcium;hydroxy phosphate;silane

H5CaO5PSi — CID 174493436

IUPACcalcium;hydroxy phosphate;silane
SMILESO=P([O-])([O-])OO.[Ca+2].[SiH4]
InChIInChI=1S/Ca.H3O5P.H4Si/c;1-5-6(2,3)4;/h;1H,(H2,2,3,4);1H4/q+2;;/p-2
InChIKeyMEABBDXEOLAIPO-UHFFFAOYSA-L
MW184.17 g/mol
LogP-3.53
Rot. Bonds1

About calcium;hydroxy phosphate;silane

calcium;hydroxy phosphate;silane (PubChem CID 174493436) has the molecular formula H5CaO5PSi and a molecular weight of 184.17 g/mol. Its IUPAC name is calcium;hydroxy phosphate;silane.

Molecular Properties

Compound Namecalcium;hydroxy phosphate;silane
PubChem CID174493436
Molecular FormulaH5CaO5PSi
Molecular Weight184.17 g/mol
Exact Mass183.93
IUPAC Namecalcium;hydroxy phosphate;silane
SMILESO=P([O-])([O-])OO.[Ca+2].[SiH4]
InChIInChI=1S/Ca.H3O5P.H4Si/c;1-5-6(2,3)4;/h;1H,(H2,2,3,4);1H4/q+2;;/p-2
InChIKeyMEABBDXEOLAIPO-UHFFFAOYSA-L
XLogP-3.53
TPSA92.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.17
LogP ≤ 5-3.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

pentacalcium;hydroxy phosphate
CID 23186977
sodium hydroxy phosphate
CID 23085561
bis(chromium(3+));hydroxy phosphate
CID 175358449
hydroxy phosphate;iron(2+);manganese
CID 175368870
sodium;fluoro(hydroperoxy)phosphinate;vanadium
CID 175014270
dicalcium;phosphonatooxy phosphate
CID 25022457
nonacalcium;trisodium;heptaphosphate
CID 173013514
calcium;sodium;dihydrogen phosphate;dichloride
CID 174783945
calcium;sodium;phosphoric acid;phosphate
CID 173179477
sodium dihydroxy(32P)phosphinate
CID 23694678
hexakis(dihydrogen phosphate);molybdenum
CID 18504359
trisodium;hydrogen peroxide;phosphate
CID 161125728

Frequently Asked Questions

What is the IUPAC name of calcium;hydroxy phosphate;silane?
The IUPAC name of calcium;hydroxy phosphate;silane (CID 174493436) is calcium;hydroxy phosphate;silane.
What is the SMILES notation for calcium;hydroxy phosphate;silane?
The canonical SMILES for calcium;hydroxy phosphate;silane is O=P([O-])([O-])OO.[Ca+2].[SiH4].
What is the InChIKey of calcium;hydroxy phosphate;silane?
The InChIKey is MEABBDXEOLAIPO-UHFFFAOYSA-L. The full InChI is InChI=1S/Ca.H3O5P.H4Si/c;1-5-6(2,3)4;/h;1H,(H2,2,3,4);1H4/q+2;;/p-2.
What are the key properties of calcium;hydroxy phosphate;silane?
calcium;hydroxy phosphate;silane has a molecular weight of 184.17 g/mol, XLogP of -3.53, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;hydroxy phosphate;silane is sourced from PubChem (CID 174493436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).