lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen

C3H14AlLiO2 — CID 174702312

IUPAClithium;hydride;1-methoxyethoxyalumane;molecular hydrogen
SMILESCOC(C)O[AlH2].[H-].[H][H].[H][H].[Li+]
InChIInChI=1S/C3H7O2.Al.Li.2H2.3H/c1-3(4)5-2;;;;;;;/h3H,1-2H3;;;2*1H;;;/q-1;2*+1;;;;;-1
InChIKeyJUCKVGPTVMYNBW-UHFFFAOYSA-N
MW116.07 g/mol
LogP-2.85
Rot. Bonds2

About lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen

lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen (PubChem CID 174702312) has the molecular formula C3H14AlLiO2 and a molecular weight of 116.07 g/mol. Its IUPAC name is lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen.

Molecular Properties

Compound Namelithium;hydride;1-methoxyethoxyalumane;molecular hydrogen
PubChem CID174702312
Molecular FormulaC3H14AlLiO2
Molecular Weight116.07 g/mol
Exact Mass116.10
IUPAC Namelithium;hydride;1-methoxyethoxyalumane;molecular hydrogen
SMILESCOC(C)O[AlH2].[H-].[H][H].[H][H].[Li+]
InChIInChI=1S/C3H7O2.Al.Li.2H2.3H/c1-3(4)5-2;;;;;;;/h3H,1-2H3;;;2*1H;;;/q-1;2*+1;;;;;-1
InChIKeyJUCKVGPTVMYNBW-UHFFFAOYSA-N
XLogP-2.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.07
LogP ≤ 5-2.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

lithium;1,1-dimethoxyethane;hydride
CID 174450087
lithium;hydride;1-[(2-methylpropan-2-yl)oxy]ethoxyalumane
CID 175098848
1,1-dimethoxyethane;hafnium
CID 159457910
1,1-dimethoxyethane chloride
CID 22648542
zinc;1,1-dimethoxyethane;dichloride
CID 173213885
1,2-dimethoxyethoxyalumane;molecular hydrogen
CID 175246943
sodium;bis(1-methoxyethoxy)alumanylium;hydride
CID 173394077
CID 21336188
CID 21336188
1,1-dimethoxyethane;trichloroniobium
CID 19377144
tetrakis[(1S)-1-methoxyethyl] silicate
CID 124630582
1-(1-methoxyethoxy)ethoxyphosphane
CID 174691665
methoxy-(1-methoxyethoxy)-oxophosphanium
CID 67892497

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen?
The IUPAC name of lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen (CID 174702312) is lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen.
What is the SMILES notation for lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen?
The canonical SMILES for lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen is COC(C)O[AlH2].[H-].[H][H].[H][H].[Li+].
What is the InChIKey of lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen?
The InChIKey is JUCKVGPTVMYNBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O2.Al.Li.2H2.3H/c1-3(4)5-2;;;;;;;/h3H,1-2H3;;;2*1H;;;/q-1;2*+1;;;;;-1.
What are the key properties of lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen?
lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen has a molecular weight of 116.07 g/mol, XLogP of -2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;1-methoxyethoxyalumane;molecular hydrogen is sourced from PubChem (CID 174702312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).