CID 172762611

CrFeLi — CID 172762611

IUPAC—
SMILES[Cr].[Fe].[Li]
InChIInChI=1S/Cr.Fe.Li
InChIKeyLWUHHUVVKSJHEH-UHFFFAOYSA-N
MW114.78 g/mol
LogP-0.39
Rot. Bonds

About CID 172762611

CID 172762611 (PubChem CID 172762611) has the molecular formula CrFeLi and a molecular weight of 114.78 g/mol.

Molecular Properties

Compound NameCID 172762611
PubChem CID172762611
Molecular FormulaCrFeLi
Molecular Weight114.78 g/mol
Exact Mass114.89
IUPAC Name—
SMILES[Cr].[Fe].[Li]
InChIInChI=1S/Cr.Fe.Li
InChIKeyLWUHHUVVKSJHEH-UHFFFAOYSA-N
XLogP-0.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.78
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 172762611 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 172762611?
The IUPAC name of CID 172762611 (CID 172762611) is not available.
What is the SMILES notation for CID 172762611?
The canonical SMILES for CID 172762611 is [Cr].[Fe].[Li].
What is the InChIKey of CID 172762611?
The InChIKey is LWUHHUVVKSJHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/Cr.Fe.Li.
What are the key properties of CID 172762611?
CID 172762611 has a molecular weight of 114.78 g/mol, XLogP of -0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172762611 is sourced from PubChem (CID 172762611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).