gallium tris(2-methoxyethanolate)

C9H21GaO6 — CID 101193037

IUPACgallium tris(2-methoxyethanolate)
SMILESCOCC[O-].COCC[O-].COCC[O-].[Ga+3]
InChIInChI=1S/3C3H7O2.Ga/c3*1-5-3-2-4;/h3*2-3H2,1H3;/q3*-1;+3
InChIKeyWNTCUHQRZWTBDK-UHFFFAOYSA-N
MW294.98 g/mol
LogP-3.40
Rot. Bonds6

About gallium tris(2-methoxyethanolate)

gallium tris(2-methoxyethanolate) (PubChem CID 101193037) has the molecular formula C9H21GaO6 and a molecular weight of 294.98 g/mol. Its IUPAC name is gallium tris(2-methoxyethanolate).

Molecular Properties

Compound Namegallium tris(2-methoxyethanolate)
PubChem CID101193037
Molecular FormulaC9H21GaO6
Molecular Weight294.98 g/mol
Exact Mass294.06
IUPAC Namegallium tris(2-methoxyethanolate)
SMILESCOCC[O-].COCC[O-].COCC[O-].[Ga+3]
InChIInChI=1S/3C3H7O2.Ga/c3*1-5-3-2-4;/h3*2-3H2,1H3;/q3*-1;+3
InChIKeyWNTCUHQRZWTBDK-UHFFFAOYSA-N
XLogP-3.40
TPSA96.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.98
LogP ≤ 5-3.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of gallium tris(2-methoxyethanolate)?
The IUPAC name of gallium tris(2-methoxyethanolate) (CID 101193037) is gallium tris(2-methoxyethanolate).
What is the SMILES notation for gallium tris(2-methoxyethanolate)?
The canonical SMILES for gallium tris(2-methoxyethanolate) is COCC[O-].COCC[O-].COCC[O-].[Ga+3].
What is the InChIKey of gallium tris(2-methoxyethanolate)?
The InChIKey is WNTCUHQRZWTBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C3H7O2.Ga/c3*1-5-3-2-4;/h3*2-3H2,1H3;/q3*-1;+3.
What are the key properties of gallium tris(2-methoxyethanolate)?
gallium tris(2-methoxyethanolate) has a molecular weight of 294.98 g/mol, XLogP of -3.40, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for gallium tris(2-methoxyethanolate) is sourced from PubChem (CID 101193037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).