chromium(2+);sulfate;hydrate

H2CrO5S — CID 142709244

IUPACchromium(2+);sulfate;hydrate
SMILESO.O=S(=O)([O-])[O-].[Cr+2]
InChIInChI=1S/Cr.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
InChIKeyBFKDGPYHRYMCEV-UHFFFAOYSA-L
MW166.07 g/mol
LogP-2.17
Rot. Bonds

About chromium(2+);sulfate;hydrate

chromium(2+);sulfate;hydrate (PubChem CID 142709244) has the molecular formula H2CrO5S and a molecular weight of 166.07 g/mol. Its IUPAC name is chromium(2+);sulfate;hydrate.

Molecular Properties

Compound Namechromium(2+);sulfate;hydrate
PubChem CID142709244
Molecular FormulaH2CrO5S
Molecular Weight166.07 g/mol
Exact Mass165.90
IUPAC Namechromium(2+);sulfate;hydrate
SMILESO.O=S(=O)([O-])[O-].[Cr+2]
InChIInChI=1S/Cr.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
InChIKeyBFKDGPYHRYMCEV-UHFFFAOYSA-L
XLogP-2.17
TPSA111.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.07
LogP ≤ 5-2.17
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'}

Analyze chromium(2+);sulfate;hydrate 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 chromium(2+);sulfate;hydrate?
The IUPAC name of chromium(2+);sulfate;hydrate (CID 142709244) is chromium(2+);sulfate;hydrate.
What is the SMILES notation for chromium(2+);sulfate;hydrate?
The canonical SMILES for chromium(2+);sulfate;hydrate is O.O=S(=O)([O-])[O-].[Cr+2].
What is the InChIKey of chromium(2+);sulfate;hydrate?
The InChIKey is BFKDGPYHRYMCEV-UHFFFAOYSA-L. The full InChI is InChI=1S/Cr.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2.
What are the key properties of chromium(2+);sulfate;hydrate?
chromium(2+);sulfate;hydrate has a molecular weight of 166.07 g/mol, XLogP of -2.17, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(2+);sulfate;hydrate is sourced from PubChem (CID 142709244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).