chromium(3+);sulfate;hexahydrate

H12CrO10S+ — CID 21126657

IUPACchromium(3+);sulfate;hexahydrate
SMILESO.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+3]
InChIInChI=1S/Cr.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+3;;;;;;;/p-2
InChIKeyUUEWGTVTXGOFRY-UHFFFAOYSA-L
MW256.15 g/mol
LogP-6.29
Rot. Bonds

About chromium(3+);sulfate;hexahydrate

chromium(3+);sulfate;hexahydrate (PubChem CID 21126657) has the molecular formula H12CrO10S+ and a molecular weight of 256.15 g/mol. Its IUPAC name is chromium(3+);sulfate;hexahydrate.

Molecular Properties

Compound Namechromium(3+);sulfate;hexahydrate
PubChem CID21126657
Molecular FormulaH12CrO10S+
Molecular Weight256.15 g/mol
Exact Mass255.96
IUPAC Namechromium(3+);sulfate;hexahydrate
SMILESO.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+3]
InChIInChI=1S/Cr.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+3;;;;;;;/p-2
InChIKeyUUEWGTVTXGOFRY-UHFFFAOYSA-L
XLogP-6.29
TPSA269.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 5-6.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chromium(3+);sulfate;hexahydrate?
The IUPAC name of chromium(3+);sulfate;hexahydrate (CID 21126657) is chromium(3+);sulfate;hexahydrate.
What is the SMILES notation for chromium(3+);sulfate;hexahydrate?
The canonical SMILES for chromium(3+);sulfate;hexahydrate is O.O.O.O.O.O.O=S(=O)([O-])[O-].[Cr+3].
What is the InChIKey of chromium(3+);sulfate;hexahydrate?
The InChIKey is UUEWGTVTXGOFRY-UHFFFAOYSA-L. The full InChI is InChI=1S/Cr.H2O4S.6H2O/c;1-5(2,3)4;;;;;;/h;(H2,1,2,3,4);6*1H2/q+3;;;;;;;/p-2.
What are the key properties of chromium(3+);sulfate;hexahydrate?
chromium(3+);sulfate;hexahydrate has a molecular weight of 256.15 g/mol, XLogP of -6.29, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(3+);sulfate;hexahydrate is sourced from PubChem (CID 21126657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).