CID 173235382

H2AlBCaZn — CID 173235382

IUPAC—
SMILES[Al].[B].[Ca+2].[H-].[H-].[Zn]
InChIInChI=1S/Al.B.Ca.Zn.2H/q;;+2;;2*-1
InChIKeySJXYANUCKHZEMJ-UHFFFAOYSA-N
MW145.28 g/mol
LogP-0.92
Rot. Bonds

About CID 173235382

CID 173235382 (PubChem CID 173235382) has the molecular formula H2AlBCaZn and a molecular weight of 145.28 g/mol.

Molecular Properties

Compound NameCID 173235382
PubChem CID173235382
Molecular FormulaH2AlBCaZn
Molecular Weight145.28 g/mol
Exact Mass143.90
IUPAC Name—
SMILES[Al].[B].[Ca+2].[H-].[H-].[Zn]
InChIInChI=1S/Al.B.Ca.Zn.2H/q;;+2;;2*-1
InChIKeySJXYANUCKHZEMJ-UHFFFAOYSA-N
XLogP-0.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.28
LogP ≤ 5-0.92
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 173235382?
The IUPAC name of CID 173235382 (CID 173235382) is not available.
What is the SMILES notation for CID 173235382?
The canonical SMILES for CID 173235382 is [Al].[B].[Ca+2].[H-].[H-].[Zn].
What is the InChIKey of CID 173235382?
The InChIKey is SJXYANUCKHZEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.B.Ca.Zn.2H/q;;+2;;2*-1.
What are the key properties of CID 173235382?
CID 173235382 has a molecular weight of 145.28 g/mol, XLogP of -0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173235382 is sourced from PubChem (CID 173235382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).