45% in Water

B2CuF8-2 — CID 170999885

IUPAC—
SMILESF[B-](F)(F)F.F[B-](F)(F)F.[Cu]
InChIInChI=1S/2BF4.Cu/c2*2-1(3,4)5;/q2*-1;
InChIKeyMXEUSMYDFBQDAV-UHFFFAOYSA-N
MW237.15 g/mol
LogP2.60
Rot. Bonds

About 45% in Water

45% in Water (PubChem CID 170999885) has the molecular formula B2CuF8-2 and a molecular weight of 237.15 g/mol.

Molecular Properties

Compound Name45% in Water
PubChem CID170999885
Molecular FormulaB2CuF8-2
Molecular Weight237.15 g/mol
Exact Mass236.94
IUPAC Name—
SMILESF[B-](F)(F)F.F[B-](F)(F)F.[Cu]
InChIInChI=1S/2BF4.Cu/c2*2-1(3,4)5;/q2*-1;
InChIKeyMXEUSMYDFBQDAV-UHFFFAOYSA-N
XLogP2.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.15
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 45% in Water?
The IUPAC name of 45% in Water (CID 170999885) is not available.
What is the SMILES notation for 45% in Water?
The canonical SMILES for 45% in Water is F[B-](F)(F)F.F[B-](F)(F)F.[Cu].
What is the InChIKey of 45% in Water?
The InChIKey is MXEUSMYDFBQDAV-UHFFFAOYSA-N. The full InChI is InChI=1S/2BF4.Cu/c2*2-1(3,4)5;/q2*-1;.
What are the key properties of 45% in Water?
45% in Water has a molecular weight of 237.15 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 45% in Water is sourced from PubChem (CID 170999885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).