aluminum;tris(cobalt(2+));triborate

AlB3Co3O9 — CID 173359634

IUPACaluminum;tris(cobalt(2+));triborate
SMILES[Al+3].[Co+2].[Co+2].[Co+2].[O-]B([O-])[O-].[O-]B([O-])[O-].[O-]B([O-])[O-]
InChIInChI=1S/Al.3BO3.3Co/c;3*2-1(3)4;;;/q+3;3*-3;3*+2
InChIKeyQJQVXVIFOUUEJU-UHFFFAOYSA-N
MW380.21 g/mol
LogP-12.23
Rot. Bonds

About aluminum;tris(cobalt(2+));triborate

aluminum;tris(cobalt(2+));triborate (PubChem CID 173359634) has the molecular formula AlB3Co3O9 and a molecular weight of 380.21 g/mol. Its IUPAC name is aluminum;tris(cobalt(2+));triborate.

Molecular Properties

Compound Namealuminum;tris(cobalt(2+));triborate
PubChem CID173359634
Molecular FormulaAlB3Co3O9
Molecular Weight380.21 g/mol
Exact Mass380.76
IUPAC Namealuminum;tris(cobalt(2+));triborate
SMILES[Al+3].[Co+2].[Co+2].[Co+2].[O-]B([O-])[O-].[O-]B([O-])[O-].[O-]B([O-])[O-]
InChIInChI=1S/Al.3BO3.3Co/c;3*2-1(3)4;;;/q+3;3*-3;3*+2
InChIKeyQJQVXVIFOUUEJU-UHFFFAOYSA-N
XLogP-12.23
TPSA207.54 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.21
LogP ≤ 5-12.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

dialuminum diborate
CID 22359065
tetraaluminum;triborate;trihydroxide
CID 173042860
aluminum;gadolinium;borate
CID 174462656
aluminum;lutetium(3+);borate
CID 18964317
trialuminum;yttrium(3+);tetraborate
CID 117065339
aluminum;copper;borate
CID 86742028
aluminum;cerium(3+);borate
CID 19825559
aluminum;samarium(3+);diborate
CID 161016046
hexamagnesium;tetraborate
CID 19981642
tetraborate;pentahydrate
CID 18463322
dibismuth diborate
CID 159089298
trisulfanium;borate
CID 22561123

Frequently Asked Questions

What is the IUPAC name of aluminum;tris(cobalt(2+));triborate?
The IUPAC name of aluminum;tris(cobalt(2+));triborate (CID 173359634) is aluminum;tris(cobalt(2+));triborate.
What is the SMILES notation for aluminum;tris(cobalt(2+));triborate?
The canonical SMILES for aluminum;tris(cobalt(2+));triborate is [Al+3].[Co+2].[Co+2].[Co+2].[O-]B([O-])[O-].[O-]B([O-])[O-].[O-]B([O-])[O-].
What is the InChIKey of aluminum;tris(cobalt(2+));triborate?
The InChIKey is QJQVXVIFOUUEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.3BO3.3Co/c;3*2-1(3)4;;;/q+3;3*-3;3*+2.
What are the key properties of aluminum;tris(cobalt(2+));triborate?
aluminum;tris(cobalt(2+));triborate has a molecular weight of 380.21 g/mol, XLogP of -12.23, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;tris(cobalt(2+));triborate is sourced from PubChem (CID 173359634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).