calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc

H6CaCdCrO8SZn — CID 175273485

IUPACcalcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc
SMILESO=S(=O)(O)O.O=[Cr](=O)(O)O.[Ca+2].[Cd].[H-].[H-].[Zn]
InChIInChI=1S/Ca.Cd.Cr.H2O4S.2H2O.2O.Zn.2H/c;;;1-5(2,3)4;;;;;;;/h;;;(H2,1,2,3,4);2*1H2;;;;;/q+2;;+2;;;;;;;2*-1/p-2
InChIKeyKBNDFJJQJWGMLV-UHFFFAOYSA-L
MW435.98 g/mol
LogP-2.17
Rot. Bonds

About calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc

calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc (PubChem CID 175273485) has the molecular formula H6CaCdCrO8SZn and a molecular weight of 435.98 g/mol. Its IUPAC name is calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc.

Molecular Properties

Compound Namecalcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc
PubChem CID175273485
Molecular FormulaH6CaCdCrO8SZn
Molecular Weight435.98 g/mol
Exact Mass435.71
IUPAC Namecalcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc
SMILESO=S(=O)(O)O.O=[Cr](=O)(O)O.[Ca+2].[Cd].[H-].[H-].[Zn]
InChIInChI=1S/Ca.Cd.Cr.H2O4S.2H2O.2O.Zn.2H/c;;;1-5(2,3)4;;;;;;;/h;;;(H2,1,2,3,4);2*1H2;;;;;/q+2;;+2;;;;;;;2*-1/p-2
InChIKeyKBNDFJJQJWGMLV-UHFFFAOYSA-L
XLogP-2.17
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.98
LogP ≤ 5-2.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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

barium(2+);dihydroxy(dioxo)chromium;hydride;sulfuric acid
CID 173053318
calcium;cadmium;dihydroxy(dioxo)chromium;hydride;zinc
CID 173432569
calcium;barium(2+);hydride;sulfuric acid;zinc
CID 174925769
barium(2+);dihydroxy(dioxo)chromium;hydride;zinc
CID 173175751
dicalcium;hydride;sulfuric acid;hydrate
CID 173153468
dicalcium;hydride;sulfuric acid;hydrochloride
CID 173127277
dicalcium;hydride;sulfuric acid;pentahydrate
CID 173205930
dicalcium;hydride;sulfuric acid;dihydrate
CID 173090602
calcium;hydride;sulfuric acid;hydrochloride
CID 173159750
sodium;hydride;sulfuric acid;zinc
CID 173223008
calcium;dihydroxy(dioxo)chromium;hydride;lanthanum
CID 173362467
sulfuric acid;zinc
CID 173312320

Frequently Asked Questions

What is the IUPAC name of calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc?
The IUPAC name of calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc (CID 175273485) is calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc.
What is the SMILES notation for calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc?
The canonical SMILES for calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc is O=S(=O)(O)O.O=[Cr](=O)(O)O.[Ca+2].[Cd].[H-].[H-].[Zn].
What is the InChIKey of calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc?
The InChIKey is KBNDFJJQJWGMLV-UHFFFAOYSA-L. The full InChI is InChI=1S/Ca.Cd.Cr.H2O4S.2H2O.2O.Zn.2H/c;;;1-5(2,3)4;;;;;;;/h;;;(H2,1,2,3,4);2*1H2;;;;;/q+2;;+2;;;;;;;2*-1/p-2.
What are the key properties of calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc?
calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc has a molecular weight of 435.98 g/mol, XLogP of -2.17, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;cadmium;dihydroxy(dioxo)chromium;hydride;sulfuric acid;zinc is sourced from PubChem (CID 175273485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).