methoxymethylalumane;molecular hydrogen

C2H9AlO — CID 174321671

IUPACmethoxymethylalumane;molecular hydrogen
SMILESCOC[AlH2].[H][H]
InChIInChI=1S/C2H5O.Al.H2.2H/c1-3-2;;;;/h1H2,2H3;;1H;;
InChIKeyISOVLPFIHZOLGU-UHFFFAOYSA-N
MW76.07 g/mol
LogP-0.53
Rot. Bonds1

About methoxymethylalumane;molecular hydrogen

methoxymethylalumane;molecular hydrogen (PubChem CID 174321671) has the molecular formula C2H9AlO and a molecular weight of 76.07 g/mol. Its IUPAC name is methoxymethylalumane;molecular hydrogen.

Molecular Properties

Compound Namemethoxymethylalumane;molecular hydrogen
PubChem CID174321671
Molecular FormulaC2H9AlO
Molecular Weight76.07 g/mol
Exact Mass76.05
IUPAC Namemethoxymethylalumane;molecular hydrogen
SMILESCOC[AlH2].[H][H]
InChIInChI=1S/C2H5O.Al.H2.2H/c1-3-2;;;;/h1H2,2H3;;1H;;
InChIKeyISOVLPFIHZOLGU-UHFFFAOYSA-N
XLogP-0.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.07
LogP ≤ 5-0.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methoxymethylalumane;molecular hydrogen?
The IUPAC name of methoxymethylalumane;molecular hydrogen (CID 174321671) is methoxymethylalumane;molecular hydrogen.
What is the SMILES notation for methoxymethylalumane;molecular hydrogen?
The canonical SMILES for methoxymethylalumane;molecular hydrogen is COC[AlH2].[H][H].
What is the InChIKey of methoxymethylalumane;molecular hydrogen?
The InChIKey is ISOVLPFIHZOLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O.Al.H2.2H/c1-3-2;;;;/h1H2,2H3;;1H;;.
What are the key properties of methoxymethylalumane;molecular hydrogen?
methoxymethylalumane;molecular hydrogen has a molecular weight of 76.07 g/mol, XLogP of -0.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethylalumane;molecular hydrogen is sourced from PubChem (CID 174321671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).