aluminum;nickel;trihydroxide;dihydrate

H7AlNiO5 — CID 175327406

IUPACaluminum;nickel;trihydroxide;dihydrate
SMILESO.O.[Al+3].[Ni].[OH-].[OH-].[OH-]
InChIInChI=1S/Al.Ni.5H2O/h;;5*1H2/q+3;;;;;;/p-3
InChIKeyXGNTXMSBJKTMDW-UHFFFAOYSA-K
MW172.73 g/mol
LogP-2.56
Rot. Bonds

About aluminum;nickel;trihydroxide;dihydrate

aluminum;nickel;trihydroxide;dihydrate (PubChem CID 175327406) has the molecular formula H7AlNiO5 and a molecular weight of 172.73 g/mol. Its IUPAC name is aluminum;nickel;trihydroxide;dihydrate.

Molecular Properties

Compound Namealuminum;nickel;trihydroxide;dihydrate
PubChem CID175327406
Molecular FormulaH7AlNiO5
Molecular Weight172.73 g/mol
Exact Mass171.95
IUPAC Namealuminum;nickel;trihydroxide;dihydrate
SMILESO.O.[Al+3].[Ni].[OH-].[OH-].[OH-]
InChIInChI=1S/Al.Ni.5H2O/h;;5*1H2/q+3;;;;;;/p-3
InChIKeyXGNTXMSBJKTMDW-UHFFFAOYSA-K
XLogP-2.56
TPSA153.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.73
LogP ≤ 5-2.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze aluminum;nickel;trihydroxide;dihydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of aluminum;nickel;trihydroxide;dihydrate?
The IUPAC name of aluminum;nickel;trihydroxide;dihydrate (CID 175327406) is aluminum;nickel;trihydroxide;dihydrate.
What is the SMILES notation for aluminum;nickel;trihydroxide;dihydrate?
The canonical SMILES for aluminum;nickel;trihydroxide;dihydrate is O.O.[Al+3].[Ni].[OH-].[OH-].[OH-].
What is the InChIKey of aluminum;nickel;trihydroxide;dihydrate?
The InChIKey is XGNTXMSBJKTMDW-UHFFFAOYSA-K. The full InChI is InChI=1S/Al.Ni.5H2O/h;;5*1H2/q+3;;;;;;/p-3.
What are the key properties of aluminum;nickel;trihydroxide;dihydrate?
aluminum;nickel;trihydroxide;dihydrate has a molecular weight of 172.73 g/mol, XLogP of -2.56, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;nickel;trihydroxide;dihydrate is sourced from PubChem (CID 175327406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).