chromium(3+);cobalt(2+);disulfate

CoCrO8S2+ — CID 163918913

IUPACchromium(3+);cobalt(2+);disulfate
SMILESO=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Co+2].[Cr+3]
InChIInChI=1S/Co.Cr.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+2;+3;;/p-4
InChIKeyQYSBDYHXXOIHNZ-UHFFFAOYSA-J
MW303.06 g/mol
LogP-2.68
Rot. Bonds

About chromium(3+);cobalt(2+);disulfate

chromium(3+);cobalt(2+);disulfate (PubChem CID 163918913) has the molecular formula CoCrO8S2+ and a molecular weight of 303.06 g/mol. Its IUPAC name is chromium(3+);cobalt(2+);disulfate.

Molecular Properties

Compound Namechromium(3+);cobalt(2+);disulfate
PubChem CID163918913
Molecular FormulaCoCrO8S2+
Molecular Weight303.06 g/mol
Exact Mass302.78
IUPAC Namechromium(3+);cobalt(2+);disulfate
SMILESO=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Co+2].[Cr+3]
InChIInChI=1S/Co.Cr.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+2;+3;;/p-4
InChIKeyQYSBDYHXXOIHNZ-UHFFFAOYSA-J
XLogP-2.68
TPSA160.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.06
LogP ≤ 5-2.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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+);cobalt(2+);disulfate?
The IUPAC name of chromium(3+);cobalt(2+);disulfate (CID 163918913) is chromium(3+);cobalt(2+);disulfate.
What is the SMILES notation for chromium(3+);cobalt(2+);disulfate?
The canonical SMILES for chromium(3+);cobalt(2+);disulfate is O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Co+2].[Cr+3].
What is the InChIKey of chromium(3+);cobalt(2+);disulfate?
The InChIKey is QYSBDYHXXOIHNZ-UHFFFAOYSA-J. The full InChI is InChI=1S/Co.Cr.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+2;+3;;/p-4.
What are the key properties of chromium(3+);cobalt(2+);disulfate?
chromium(3+);cobalt(2+);disulfate has a molecular weight of 303.06 g/mol, XLogP of -2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(3+);cobalt(2+);disulfate is sourced from PubChem (CID 163918913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).