alumane;chloro hydrogen sulfate;iron

H4AlClFeO4S — CID 174709117

IUPACalumane;chloro hydrogen sulfate;iron
SMILESO=S(=O)(O)OCl.[AlH3].[Fe]
InChIInChI=1S/Al.ClHO4S.Fe.3H/c;1-5-6(2,3)4;;;;/h;(H,2,3,4);;;;
InChIKeyBGHDOMCCAGHZNF-UHFFFAOYSA-N
MW218.38 g/mol
LogP-1.23
Rot. Bonds1

About alumane;chloro hydrogen sulfate;iron

alumane;chloro hydrogen sulfate;iron (PubChem CID 174709117) has the molecular formula H4AlClFeO4S and a molecular weight of 218.38 g/mol. Its IUPAC name is alumane;chloro hydrogen sulfate;iron.

Molecular Properties

Compound Namealumane;chloro hydrogen sulfate;iron
PubChem CID174709117
Molecular FormulaH4AlClFeO4S
Molecular Weight218.38 g/mol
Exact Mass217.87
IUPAC Namealumane;chloro hydrogen sulfate;iron
SMILESO=S(=O)(O)OCl.[AlH3].[Fe]
InChIInChI=1S/Al.ClHO4S.Fe.3H/c;1-5-6(2,3)4;;;;/h;(H,2,3,4);;;;
InChIKeyBGHDOMCCAGHZNF-UHFFFAOYSA-N
XLogP-1.23
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.38
LogP ≤ 5-1.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

chloro hydrogen sulfate;iron
CID 173330571
barium(2+);chloro hydrogen sulfate;hydride
CID 174563479
alumane;sulfuric acid
CID 173042837
sulfuric acid;trichloroiron
CID 162013625
sulfooxy hydrogen sulfate
CID 24413
iron;sulfuric acid;hydrate
CID 516917
alumane;sulfuric acid;vanadium
CID 174978121
iron;λ2-plumbane;sulfuric acid
CID 173358356
alumane;copper;sulfuric acid
CID 173042955
alumane;sulfuric acid;hexahydrate
CID 174932074
beryllium;hydride;sulfuric acid
CID 174664127
alumane;sulfuric acid;hexahydrate
CID 173018809

Frequently Asked Questions

What is the IUPAC name of alumane;chloro hydrogen sulfate;iron?
The IUPAC name of alumane;chloro hydrogen sulfate;iron (CID 174709117) is alumane;chloro hydrogen sulfate;iron.
What is the SMILES notation for alumane;chloro hydrogen sulfate;iron?
The canonical SMILES for alumane;chloro hydrogen sulfate;iron is O=S(=O)(O)OCl.[AlH3].[Fe].
What is the InChIKey of alumane;chloro hydrogen sulfate;iron?
The InChIKey is BGHDOMCCAGHZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.ClHO4S.Fe.3H/c;1-5-6(2,3)4;;;;/h;(H,2,3,4);;;;.
What are the key properties of alumane;chloro hydrogen sulfate;iron?
alumane;chloro hydrogen sulfate;iron has a molecular weight of 218.38 g/mol, XLogP of -1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;chloro hydrogen sulfate;iron is sourced from PubChem (CID 174709117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).