CID 174604504

H4BCaMgZn — CID 174604504

IUPAC
SMILES[B].[Ca+2].[H-].[H-].[H-].[H-].[Mg+2].[Zn]
InChIInChI=1S/B.Ca.Mg.Zn.4H/q;2*+2;;4*-1
InChIKeyUKMZQNBWHGJXHW-UHFFFAOYSA-N
MW144.62 g/mol
LogP-0.69
Rot. Bonds

About CID 174604504

CID 174604504 (PubChem CID 174604504) has the molecular formula H4BCaMgZn and a molecular weight of 144.62 g/mol.

Molecular Properties

Compound NameCID 174604504
PubChem CID174604504
Molecular FormulaH4BCaMgZn
Molecular Weight144.62 g/mol
Exact Mass142.92
IUPAC Name
SMILES[B].[Ca+2].[H-].[H-].[H-].[H-].[Mg+2].[Zn]
InChIInChI=1S/B.Ca.Mg.Zn.4H/q;2*+2;;4*-1
InChIKeyUKMZQNBWHGJXHW-UHFFFAOYSA-N
XLogP-0.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.62
LogP ≤ 5-0.69
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 CID 174604504?
The IUPAC name of CID 174604504 (CID 174604504) is not available.
What is the SMILES notation for CID 174604504?
The canonical SMILES for CID 174604504 is [B].[Ca+2].[H-].[H-].[H-].[H-].[Mg+2].[Zn].
What is the InChIKey of CID 174604504?
The InChIKey is UKMZQNBWHGJXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/B.Ca.Mg.Zn.4H/q;2*+2;;4*-1.
What are the key properties of CID 174604504?
CID 174604504 has a molecular weight of 144.62 g/mol, XLogP of -0.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174604504 is sourced from PubChem (CID 174604504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).