CID 6327572

C6H18AlO3 — CID 6327572

IUPAC—
SMILESCCO.CCO.CCO.[Al]
InChIInChI=1S/3C2H6O.Al/c3*1-2-3;/h3*3H,2H2,1H3;
InChIKeyXETMUECIEOFADB-UHFFFAOYSA-N
MW165.19 g/mol
LogP-0.38
Rot. Bonds

About CID 6327572

CID 6327572 (PubChem CID 6327572) has the molecular formula C6H18AlO3 and a molecular weight of 165.19 g/mol.

Molecular Properties

Compound NameCID 6327572
PubChem CID6327572
Molecular FormulaC6H18AlO3
Molecular Weight165.19 g/mol
Exact Mass165.11
IUPAC Name—
SMILESCCO.CCO.CCO.[Al]
InChIInChI=1S/3C2H6O.Al/c3*1-2-3;/h3*3H,2H2,1H3;
InChIKeyXETMUECIEOFADB-UHFFFAOYSA-N
XLogP-0.38
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 6327572?
The IUPAC name of CID 6327572 (CID 6327572) is not available.
What is the SMILES notation for CID 6327572?
The canonical SMILES for CID 6327572 is CCO.CCO.CCO.[Al].
What is the InChIKey of CID 6327572?
The InChIKey is XETMUECIEOFADB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H6O.Al/c3*1-2-3;/h3*3H,2H2,1H3;.
What are the key properties of CID 6327572?
CID 6327572 has a molecular weight of 165.19 g/mol, XLogP of -0.38, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 6327572 is sourced from PubChem (CID 6327572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).