aluminum;furan-2-yl phosphate;hydroxide

C4H4AlO6P — CID 174460953

IUPACaluminum;furan-2-yl phosphate;hydroxide
SMILESO=P([O-])([O-])Oc1ccco1.[Al+3].[OH-]
InChIInChI=1S/C4H5O5P.Al.H2O/c5-10(6,7)9-4-2-1-3-8-4;;/h1-3H,(H2,5,6,7);;1H2/q;+3;/p-3
InChIKeyZBOXQNNFHLCICH-UHFFFAOYSA-K
MW206.03 g/mol
LogP-1.07
Rot. Bonds2

About aluminum;furan-2-yl phosphate;hydroxide

aluminum;furan-2-yl phosphate;hydroxide (PubChem CID 174460953) has the molecular formula C4H4AlO6P and a molecular weight of 206.03 g/mol. Its IUPAC name is aluminum;furan-2-yl phosphate;hydroxide.

Molecular Properties

Compound Namealuminum;furan-2-yl phosphate;hydroxide
PubChem CID174460953
Molecular FormulaC4H4AlO6P
Molecular Weight206.03 g/mol
Exact Mass205.96
IUPAC Namealuminum;furan-2-yl phosphate;hydroxide
SMILESO=P([O-])([O-])Oc1ccco1.[Al+3].[OH-]
InChIInChI=1S/C4H5O5P.Al.H2O/c5-10(6,7)9-4-2-1-3-8-4;;/h1-3H,(H2,5,6,7);;1H2/q;+3;/p-3
InChIKeyZBOXQNNFHLCICH-UHFFFAOYSA-K
XLogP-1.07
TPSA115.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.03
LogP ≤ 5-1.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze aluminum;furan-2-yl phosphate;hydroxide 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;furan-2-yl phosphate;hydroxide?
The IUPAC name of aluminum;furan-2-yl phosphate;hydroxide (CID 174460953) is aluminum;furan-2-yl phosphate;hydroxide.
What is the SMILES notation for aluminum;furan-2-yl phosphate;hydroxide?
The canonical SMILES for aluminum;furan-2-yl phosphate;hydroxide is O=P([O-])([O-])Oc1ccco1.[Al+3].[OH-].
What is the InChIKey of aluminum;furan-2-yl phosphate;hydroxide?
The InChIKey is ZBOXQNNFHLCICH-UHFFFAOYSA-K. The full InChI is InChI=1S/C4H5O5P.Al.H2O/c5-10(6,7)9-4-2-1-3-8-4;;/h1-3H,(H2,5,6,7);;1H2/q;+3;/p-3.
What are the key properties of aluminum;furan-2-yl phosphate;hydroxide?
aluminum;furan-2-yl phosphate;hydroxide has a molecular weight of 206.03 g/mol, XLogP of -1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;furan-2-yl phosphate;hydroxide is sourced from PubChem (CID 174460953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).