CAS 10022-31-8|barium(2+) ion dinitronate|barium(2+) ion bis(nitrooxidane)|Barium nitrate|Barium dinitrate|硝酸钡|barium(2+) ion dinitrate|barium(2+) ion dinitrate|Barium nitrate|硝酸钡, Puratronic&...

General Information

Structure

Molecular Formula

BaN₂O₆

Molecular Mass

261.3368

Exact Mass

261.88088273

Charge

InChI

InChI=1S/Ba.2NO3/c;2*2-1(3)4/q+2;2*-1

InChIKey

IWOUKMZUPDVPGQ-UHFFFAOYSA-N

Canonic Smiles

[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Ba+2]

Isomeric Smiles

[Ba+2].[O-][N+](=O)[O-].[O-][N+](=O)[O-]

Calculated Properties

JChem

LogD (pH = 7.4)

-2.57

LogD (pH = 5.5)

-2.57

Log P

-2.57

Rotatable Bonds

H Donor

H Acceptors

Lipinski's Rule of Five

true

Acid pKa

-9.94

Polar Surface Area

66.20

Polarizability

3.28

Molar Refractivity

8.35

Data Source

Names and Identifiers

IUPAC Traditional name

barium(2+) ion dinitronate barium(2+) ion dinitrate barium nitrate

IUPAC name

barium(2+) ion bis(nitrooxidane) barium(2+) ion dinitrate barium(2+) dinitrate

Synonyms

Barium nitrateBarium dinitrate硝酸钡Barium nitrate硝酸钡, Puratronic®Barium nitrate, Puratronic®硝酸钡, ACSBarium nitrate, ACSnitrobaritebarium nitrate (Ba(NO3)2)barium(II) nitrate (1:2)nitric acid, barium saltnitrate de baryumnitrato baricobarium(II) nitratenitric acid barium saltbarium nitratenitric acid barium salt (2:1)nitric acid, barium salt (2:1)

Names and Identifiers

Registration numbers

PubChem CID

Wikipedia Title

Chemspider ID

CAS Number

PubChem SID

24852115248530202485850816222037485389242