sodium;dimethoxy(1-methoxyethoxy)alumane;hydride

C5H14AlNaO4 — CID 88804741

IUPACsodium;dimethoxy(1-methoxyethoxy)alumane;hydride
SMILESCOC(C)O[Al](OC)OC.[H-].[Na+]
InChIInChI=1S/C3H7O2.2CH3O.Al.Na.H/c1-3(4)5-2;2*1-2;;;/h3H,1-2H3;2*1H3;;;/q3*-1;+3;+1;-1
InChIKeyRUWBOZZDDKXDSA-UHFFFAOYSA-N
MW188.13 g/mol
LogP-2.61
Rot. Bonds5

About sodium;dimethoxy(1-methoxyethoxy)alumane;hydride

sodium;dimethoxy(1-methoxyethoxy)alumane;hydride (PubChem CID 88804741) has the molecular formula C5H14AlNaO4 and a molecular weight of 188.13 g/mol. Its IUPAC name is sodium;dimethoxy(1-methoxyethoxy)alumane;hydride.

Molecular Properties

Compound Namesodium;dimethoxy(1-methoxyethoxy)alumane;hydride
PubChem CID88804741
Molecular FormulaC5H14AlNaO4
Molecular Weight188.13 g/mol
Exact Mass188.06
IUPAC Namesodium;dimethoxy(1-methoxyethoxy)alumane;hydride
SMILESCOC(C)O[Al](OC)OC.[H-].[Na+]
InChIInChI=1S/C3H7O2.2CH3O.Al.Na.H/c1-3(4)5-2;2*1-2;;;/h3H,1-2H3;2*1H3;;;/q3*-1;+3;+1;-1
InChIKeyRUWBOZZDDKXDSA-UHFFFAOYSA-N
XLogP-2.61
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.13
LogP ≤ 5-2.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze sodium;dimethoxy(1-methoxyethoxy)alumane;hydride 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 sodium;dimethoxy(1-methoxyethoxy)alumane;hydride?
The IUPAC name of sodium;dimethoxy(1-methoxyethoxy)alumane;hydride (CID 88804741) is sodium;dimethoxy(1-methoxyethoxy)alumane;hydride.
What is the SMILES notation for sodium;dimethoxy(1-methoxyethoxy)alumane;hydride?
The canonical SMILES for sodium;dimethoxy(1-methoxyethoxy)alumane;hydride is COC(C)O[Al](OC)OC.[H-].[Na+].
What is the InChIKey of sodium;dimethoxy(1-methoxyethoxy)alumane;hydride?
The InChIKey is RUWBOZZDDKXDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O2.2CH3O.Al.Na.H/c1-3(4)5-2;2*1-2;;;/h3H,1-2H3;2*1H3;;;/q3*-1;+3;+1;-1.
What are the key properties of sodium;dimethoxy(1-methoxyethoxy)alumane;hydride?
sodium;dimethoxy(1-methoxyethoxy)alumane;hydride has a molecular weight of 188.13 g/mol, XLogP of -2.61, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;dimethoxy(1-methoxyethoxy)alumane;hydride is sourced from PubChem (CID 88804741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).