chloro(methoxymethyl)alumane

C2H6AlClO — CID 174984791

IUPACchloro(methoxymethyl)alumane
SMILESCOC[AlH]Cl
InChIInChI=1S/C2H5O.Al.ClH.H/c1-3-2;;;/h1H2,2H3;;1H;/q;+1;;/p-1
InChIKeyDXCXASSOSRDNAT-UHFFFAOYSA-M
MW108.50 g/mol
LogP0.18
Rot. Bonds2

About chloro(methoxymethyl)alumane

chloro(methoxymethyl)alumane (PubChem CID 174984791) has the molecular formula C2H6AlClO and a molecular weight of 108.50 g/mol. Its IUPAC name is chloro(methoxymethyl)alumane.

Molecular Properties

Compound Namechloro(methoxymethyl)alumane
PubChem CID174984791
Molecular FormulaC2H6AlClO
Molecular Weight108.50 g/mol
Exact Mass107.99
IUPAC Namechloro(methoxymethyl)alumane
SMILESCOC[AlH]Cl
InChIInChI=1S/C2H5O.Al.ClH.H/c1-3-2;;;/h1H2,2H3;;1H;/q;+1;;/p-1
InChIKeyDXCXASSOSRDNAT-UHFFFAOYSA-M
XLogP0.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms5
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.50
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of chloro(methoxymethyl)alumane?
The IUPAC name of chloro(methoxymethyl)alumane (CID 174984791) is chloro(methoxymethyl)alumane.
What is the SMILES notation for chloro(methoxymethyl)alumane?
The canonical SMILES for chloro(methoxymethyl)alumane is COC[AlH]Cl.
What is the InChIKey of chloro(methoxymethyl)alumane?
The InChIKey is DXCXASSOSRDNAT-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5O.Al.ClH.H/c1-3-2;;;/h1H2,2H3;;1H;/q;+1;;/p-1.
What are the key properties of chloro(methoxymethyl)alumane?
chloro(methoxymethyl)alumane has a molecular weight of 108.50 g/mol, XLogP of 0.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(methoxymethyl)alumane is sourced from PubChem (CID 174984791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).