lithium triethoxyalumanuide

C6H16AlLiO3 — CID 22820120

IUPAClithium triethoxyalumanuide
SMILESCCO[AlH-](OCC)OCC.[Li+]
InChIInChI=1S/3C2H5O.Al.Li.H/c3*1-2-3;;;/h3*2H2,1H3;;;/q3*-1;+2;+1;
InChIKeyDKSFXMXMZKOQBE-UHFFFAOYSA-N
MW170.11 g/mol
LogP-2.18
Rot. Bonds6

About lithium triethoxyalumanuide

lithium triethoxyalumanuide (PubChem CID 22820120) has the molecular formula C6H16AlLiO3 and a molecular weight of 170.11 g/mol. Its IUPAC name is lithium triethoxyalumanuide.

Molecular Properties

Compound Namelithium triethoxyalumanuide
PubChem CID22820120
Molecular FormulaC6H16AlLiO3
Molecular Weight170.11 g/mol
Exact Mass170.11
IUPAC Namelithium triethoxyalumanuide
SMILESCCO[AlH-](OCC)OCC.[Li+]
InChIInChI=1S/3C2H5O.Al.Li.H/c3*1-2-3;;;/h3*2H2,1H3;;;/q3*-1;+2;+1;
InChIKeyDKSFXMXMZKOQBE-UHFFFAOYSA-N
XLogP-2.18
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.11
LogP ≤ 5-2.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of lithium triethoxyalumanuide?
The IUPAC name of lithium triethoxyalumanuide (CID 22820120) is lithium triethoxyalumanuide.
What is the SMILES notation for lithium triethoxyalumanuide?
The canonical SMILES for lithium triethoxyalumanuide is CCO[AlH-](OCC)OCC.[Li+].
What is the InChIKey of lithium triethoxyalumanuide?
The InChIKey is DKSFXMXMZKOQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H5O.Al.Li.H/c3*1-2-3;;;/h3*2H2,1H3;;;/q3*-1;+2;+1;.
What are the key properties of lithium triethoxyalumanuide?
lithium triethoxyalumanuide has a molecular weight of 170.11 g/mol, XLogP of -2.18, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium triethoxyalumanuide is sourced from PubChem (CID 22820120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).