sodium;bis(1-methoxyethoxy)alumanylium;hydride

C6H16AlNaO4 — CID 173394077

IUPACsodium;bis(1-methoxyethoxy)alumanylium;hydride
SMILESCOC(C)O[Al+]OC(C)OC.[H-].[H-].[Na+]
InChIInChI=1S/2C3H7O2.Al.Na.2H/c2*1-3(4)5-2;;;;/h2*3H,1-2H3;;;;/q2*-1;+3;+1;2*-1
InChIKeyPVDZGBSWAAALIW-UHFFFAOYSA-N
MW202.16 g/mol
LogP-2.23
Rot. Bonds6

About sodium;bis(1-methoxyethoxy)alumanylium;hydride

sodium;bis(1-methoxyethoxy)alumanylium;hydride (PubChem CID 173394077) has the molecular formula C6H16AlNaO4 and a molecular weight of 202.16 g/mol. Its IUPAC name is sodium;bis(1-methoxyethoxy)alumanylium;hydride.

Molecular Properties

Compound Namesodium;bis(1-methoxyethoxy)alumanylium;hydride
PubChem CID173394077
Molecular FormulaC6H16AlNaO4
Molecular Weight202.16 g/mol
Exact Mass202.08
IUPAC Namesodium;bis(1-methoxyethoxy)alumanylium;hydride
SMILESCOC(C)O[Al+]OC(C)OC.[H-].[H-].[Na+]
InChIInChI=1S/2C3H7O2.Al.Na.2H/c2*1-3(4)5-2;;;;/h2*3H,1-2H3;;;;/q2*-1;+3;+1;2*-1
InChIKeyPVDZGBSWAAALIW-UHFFFAOYSA-N
XLogP-2.23
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 5-2.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Aluminum methoxyethoxide
CID 21261965
Sodium;bis(1-ethoxyethoxy)alumanylium;hydride
CID 19861414
Sodium;bis(1-methoxyethoxy)alumanylium;hydride
CID 20164377
Butoxy-methoxy-(1-methoxybutoxy)alumane
CID 87178757
CID 87760960
CID 87760960
CID 87924924
CID 87924924
Bis(1-methoxyethoxy)alumanylium;hydride
CID 87949044
CID 88445214
CID 88445214
Sodium;hydride;tris(1-methoxyethoxy)alumane
CID 88516794
Sodium bis(1-methoxyethoxy)alumanuide
CID 88800672
Bis(1-methoxyethoxy)alumane
CID 88800673
Sodium;dimethoxy(1-methoxyethoxy)alumane;hydride
CID 88804741

Frequently Asked Questions

What is the IUPAC name of sodium;bis(1-methoxyethoxy)alumanylium;hydride?
The IUPAC name of sodium;bis(1-methoxyethoxy)alumanylium;hydride (CID 173394077) is sodium;bis(1-methoxyethoxy)alumanylium;hydride.
What is the SMILES notation for sodium;bis(1-methoxyethoxy)alumanylium;hydride?
The canonical SMILES for sodium;bis(1-methoxyethoxy)alumanylium;hydride is COC(C)O[Al+]OC(C)OC.[H-].[H-].[Na+].
What is the InChIKey of sodium;bis(1-methoxyethoxy)alumanylium;hydride?
The InChIKey is PVDZGBSWAAALIW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7O2.Al.Na.2H/c2*1-3(4)5-2;;;;/h2*3H,1-2H3;;;;/q2*-1;+3;+1;2*-1.
What are the key properties of sodium;bis(1-methoxyethoxy)alumanylium;hydride?
sodium;bis(1-methoxyethoxy)alumanylium;hydride has a molecular weight of 202.16 g/mol, XLogP of -2.23, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;bis(1-methoxyethoxy)alumanylium;hydride is sourced from PubChem (CID 173394077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).