dimethoxy(propan-2-yloxy)alumane

C5H13AlO3 — CID 16699909

IUPACdimethoxy(propan-2-yloxy)alumane
SMILESCO[Al](OC)OC(C)C
InChIInChI=1S/C3H7O.2CH3O.Al/c1-3(2)4;2*1-2;/h3H,1-2H3;2*1H3;/q3*-1;+3
InChIKeyXZPQMZIVPWNSHV-UHFFFAOYSA-N
MW148.14 g/mol
LogP0.69
Rot. Bonds4

About dimethoxy(propan-2-yloxy)alumane

dimethoxy(propan-2-yloxy)alumane (PubChem CID 16699909) has the molecular formula C5H13AlO3 and a molecular weight of 148.14 g/mol. Its IUPAC name is dimethoxy(propan-2-yloxy)alumane.

Molecular Properties

Compound Namedimethoxy(propan-2-yloxy)alumane
PubChem CID16699909
Molecular FormulaC5H13AlO3
Molecular Weight148.14 g/mol
Exact Mass148.07
IUPAC Namedimethoxy(propan-2-yloxy)alumane
SMILESCO[Al](OC)OC(C)C
InChIInChI=1S/C3H7O.2CH3O.Al/c1-3(2)4;2*1-2;/h3H,1-2H3;2*1H3;/q3*-1;+3
InChIKeyXZPQMZIVPWNSHV-UHFFFAOYSA-N
XLogP0.69
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of dimethoxy(propan-2-yloxy)alumane?
The IUPAC name of dimethoxy(propan-2-yloxy)alumane (CID 16699909) is dimethoxy(propan-2-yloxy)alumane.
What is the SMILES notation for dimethoxy(propan-2-yloxy)alumane?
The canonical SMILES for dimethoxy(propan-2-yloxy)alumane is CO[Al](OC)OC(C)C.
What is the InChIKey of dimethoxy(propan-2-yloxy)alumane?
The InChIKey is XZPQMZIVPWNSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O.2CH3O.Al/c1-3(2)4;2*1-2;/h3H,1-2H3;2*1H3;/q3*-1;+3.
What are the key properties of dimethoxy(propan-2-yloxy)alumane?
dimethoxy(propan-2-yloxy)alumane has a molecular weight of 148.14 g/mol, XLogP of 0.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy(propan-2-yloxy)alumane is sourced from PubChem (CID 16699909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).