CID 57469196

C6H15AlLiO3 — CID 57469196

IUPAC—
SMILESCCO[Al](OCC)OCC.[Li]
InChIInChI=1S/3C2H5O.Al.Li/c3*1-2-3;;/h3*2H2,1H3;;/q3*-1;+3;
InChIKeyOKGGRXMKBJLXHI-UHFFFAOYSA-N
MW169.11 g/mol
LogP0.70
Rot. Bonds6

About CID 57469196

CID 57469196 (PubChem CID 57469196) has the molecular formula C6H15AlLiO3 and a molecular weight of 169.11 g/mol.

Molecular Properties

Compound NameCID 57469196
PubChem CID57469196
Molecular FormulaC6H15AlLiO3
Molecular Weight169.11 g/mol
Exact Mass169.10
IUPAC Name—
SMILESCCO[Al](OCC)OCC.[Li]
InChIInChI=1S/3C2H5O.Al.Li/c3*1-2-3;;/h3*2H2,1H3;;/q3*-1;+3;
InChIKeyOKGGRXMKBJLXHI-UHFFFAOYSA-N
XLogP0.70
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.11
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze CID 57469196 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 57469196?
The IUPAC name of CID 57469196 (CID 57469196) is not available.
What is the SMILES notation for CID 57469196?
The canonical SMILES for CID 57469196 is CCO[Al](OCC)OCC.[Li].
What is the InChIKey of CID 57469196?
The InChIKey is OKGGRXMKBJLXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H5O.Al.Li/c3*1-2-3;;/h3*2H2,1H3;;/q3*-1;+3;.
What are the key properties of CID 57469196?
CID 57469196 has a molecular weight of 169.11 g/mol, XLogP of 0.70, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57469196 is sourced from PubChem (CID 57469196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).