BARIUM METABORATE

General Information

Mainterm	BARIUM METABORATE
CAS Reg.No.(or other ID)	13701-59-2
Regnum	176.180

From www.fda.gov

Computed Descriptors

2D Structure
CID	6101043
IUPAC Name	barium(2+);oxido(oxo)borane
InChI	InChI=1S/2BO2.Ba/c22-1-3;/q2-1;+2
InChI Key	QBLDFAIABQKINO-UHFFFAOYSA-N
Canonical SMILES	B(=O)[O-].B(=O)[O-].[Ba+2]
Molecular Formula	B2BaO4
Wikipedia	barium metaborate

From Pubchem

Computed Properties

Property Name	Property Value
Molecular Weight	222.943
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Complexity	7.5
CACTVS Substructure Key Fingerprint	A A A D c Q M A O A A A A A A A A A A E A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A I A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = =
Topological Polar Surface Area	80.3
Monoisotopic Mass	223.904
Exact Mass	223.904
Compound Is Canonicalized	True
Formal Charge	0
Heavy Atom Count	7
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Isotope Atom Count	0
Covalently-Bonded Unit Count	3

From Pubchem

Taxonomic Classification

Kingdom	Inorganic compounds
Superclass	Mixed metal/non-metal compounds
Class	Metalloid organides
Subclass	Metalloid oxides
Intermediate Tree Nodes	Not available
Direct Parent	Metalloid oxides
Alternative Parents	Metalloid salts Inorganic salts Inorganic oxides
Molecular Framework	Not available
Substituents	Metalloid oxide - Inorganic oxide - Inorganic salt - Inorganic metalloid salt
Description	This compound belongs to the class of inorganic compounds known as metalloid oxides. These are inorganic compounds containing an oxygen atom of an oxidation state of -2, in which the heaviest atom bonded to the oxygen is a metalloid.

From ClassyFire