Aluminumacetate

C2H7AlO4 — CID 16683978

IUPAC—
SMILESCC(=O)O[Al].O.O
InChIInChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2/q;+1;;/p-1
InChIKeyHDYRYUINDGQKMC-UHFFFAOYSA-M
MW122.06 g/mol
LogP-2.02
Rot. Bonds

About Aluminumacetate

Aluminumacetate (PubChem CID 16683978) has the molecular formula C2H7AlO4 and a molecular weight of 122.06 g/mol.

Molecular Properties

Compound NameAluminumacetate
PubChem CID16683978
Molecular FormulaC2H7AlO4
Molecular Weight122.06 g/mol
Exact Mass122.02
IUPAC Name—
SMILESCC(=O)O[Al].O.O
InChIInChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2/q;+1;;/p-1
InChIKeyHDYRYUINDGQKMC-UHFFFAOYSA-M
XLogP-2.02
TPSA89.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.06
LogP ≤ 5-2.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

deuteride;methyl acetate;hydrate
CID 160772266
acetyl acetate;zinc;dihydrate
CID 174593639
dimagnesium;acetyl acetate;hydride;tetrahydrate
CID 174549676
methyl acetate;ruthenium
CID 160799101
sodium;hydride;iodo acetate;trihydrate
CID 174829921
acetic acid;decahydrate
CID 163997764
methanol;propan-2-one;dihydrate
CID 158013024
acetic acid;ruthenium
CID 175502908
methanol;propan-2-one;hydrate
CID 86590524
acetyloxythallium
CID 141129894
bismuthane;methyl acetate
CID 174537209
copper;methyl acetate
CID 174340034

Frequently Asked Questions

What is the IUPAC name of Aluminumacetate?
The IUPAC name of Aluminumacetate (CID 16683978) is not available.
What is the SMILES notation for Aluminumacetate?
The canonical SMILES for Aluminumacetate is CC(=O)O[Al].O.O.
What is the InChIKey of Aluminumacetate?
The InChIKey is HDYRYUINDGQKMC-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2/q;+1;;/p-1.
What are the key properties of Aluminumacetate?
Aluminumacetate has a molecular weight of 122.06 g/mol, XLogP of -2.02, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Aluminumacetate is sourced from PubChem (CID 16683978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).