calcium;hydride;tetrafluoroborate

H2BCaF4- — CID 172996064

IUPACcalcium;hydride;tetrafluoroborate
SMILESF[B-](F)(F)F.[Ca+2].[H-].[H-]
InChIInChI=1S/BF4.Ca.2H/c2-1(3,4)5;;;/q-1;+2;2*-1
InChIKeyIAHNFYGUDKFXGN-UHFFFAOYSA-N
MW128.90 g/mol
LogP1.14
Rot. Bonds

About calcium;hydride;tetrafluoroborate

calcium;hydride;tetrafluoroborate (PubChem CID 172996064) has the molecular formula H2BCaF4- and a molecular weight of 128.90 g/mol. Its IUPAC name is calcium;hydride;tetrafluoroborate.

Molecular Properties

Compound Namecalcium;hydride;tetrafluoroborate
PubChem CID172996064
Molecular FormulaH2BCaF4-
Molecular Weight128.90 g/mol
Exact Mass128.98
IUPAC Namecalcium;hydride;tetrafluoroborate
SMILESF[B-](F)(F)F.[Ca+2].[H-].[H-]
InChIInChI=1S/BF4.Ca.2H/c2-1(3,4)5;;;/q-1;+2;2*-1
InChIKeyIAHNFYGUDKFXGN-UHFFFAOYSA-N
XLogP1.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.90
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

lithium;hydride;tritetrafluoroborate
CID 173077107
potassium;hydride;ditetrafluoroborate
CID 173211312
potassium;hydride;tritetrafluoroborate
CID 173004163
potassium;hydride;tetrafluoroborate
CID 173211352
magnesium;hydride;hydron;tetrafluoroborate
CID 174316593
lithium;hydride;methane;tritetrafluoroborate
CID 173272934
CID 23619108
CID 23619108
copper tetrafluoroborate
CID 173410741
cadmium(2+) ditetrafluoroborate
CID 12886773
potassium tritetrafluoroborate
CID 173046282
iridium(3+) tritetrafluoroborate
CID 18673244
lithium ditetrafluoroborate
CID 23116051

Frequently Asked Questions

What is the IUPAC name of calcium;hydride;tetrafluoroborate?
The IUPAC name of calcium;hydride;tetrafluoroborate (CID 172996064) is calcium;hydride;tetrafluoroborate.
What is the SMILES notation for calcium;hydride;tetrafluoroborate?
The canonical SMILES for calcium;hydride;tetrafluoroborate is F[B-](F)(F)F.[Ca+2].[H-].[H-].
What is the InChIKey of calcium;hydride;tetrafluoroborate?
The InChIKey is IAHNFYGUDKFXGN-UHFFFAOYSA-N. The full InChI is InChI=1S/BF4.Ca.2H/c2-1(3,4)5;;;/q-1;+2;2*-1.
What are the key properties of calcium;hydride;tetrafluoroborate?
calcium;hydride;tetrafluoroborate has a molecular weight of 128.90 g/mol, XLogP of 1.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;hydride;tetrafluoroborate is sourced from PubChem (CID 172996064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).