aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)

AlCaF3NaO6P3 — CID 175483152

IUPACaluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)
SMILES[Al+3].[Ca+2].[Na+].[O-]P([O-])F.[O-]P([O-])F.[O-]P([O-])F
InChIInChI=1S/Al.Ca.3FO2P.Na/c;;3*1-4(2)3;/q+3;+2;3*-2;+1
InChIKeyRJUDCOKNDZHDMR-UHFFFAOYSA-N
MW335.96 g/mol
LogP-7.05
Rot. Bonds

About aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)

aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane) (PubChem CID 175483152) has the molecular formula AlCaF3NaO6P3 and a molecular weight of 335.96 g/mol. Its IUPAC name is aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane).

Molecular Properties

Compound Namealuminum;calcium;sodium;tris(fluoro(dioxido)phosphane)
PubChem CID175483152
Molecular FormulaAlCaF3NaO6P3
Molecular Weight335.96 g/mol
Exact Mass335.82
IUPAC Namealuminum;calcium;sodium;tris(fluoro(dioxido)phosphane)
SMILES[Al+3].[Ca+2].[Na+].[O-]P([O-])F.[O-]P([O-])F.[O-]P([O-])F
InChIInChI=1S/Al.Ca.3FO2P.Na/c;;3*1-4(2)3;/q+3;+2;3*-2;+1
InChIKeyRJUDCOKNDZHDMR-UHFFFAOYSA-N
XLogP-7.05
TPSA138.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.96
LogP ≤ 5-7.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)?
The IUPAC name of aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane) (CID 175483152) is aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane).
What is the SMILES notation for aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)?
The canonical SMILES for aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane) is [Al+3].[Ca+2].[Na+].[O-]P([O-])F.[O-]P([O-])F.[O-]P([O-])F.
What is the InChIKey of aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)?
The InChIKey is RJUDCOKNDZHDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Ca.3FO2P.Na/c;;3*1-4(2)3;/q+3;+2;3*-2;+1.
What are the key properties of aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane)?
aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane) has a molecular weight of 335.96 g/mol, XLogP of -7.05, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;calcium;sodium;tris(fluoro(dioxido)phosphane) is sourced from PubChem (CID 175483152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).