zinc sulfo carbonate

CHO6SZn+ — CID 23463769

IUPACzinc sulfo carbonate
SMILESO=C([O-])OS(=O)(=O)O.[Zn+2]
InChIInChI=1S/CH2O6S.Zn/c2-1(3)7-8(4,5)6;/h(H,2,3)(H,4,5,6);/q;+2/p-1
InChIKeyBONNBXQMTFGLSR-UHFFFAOYSA-M
MW206.47 g/mol
LogP-1.85
Rot. Bonds1

About zinc sulfo carbonate

zinc sulfo carbonate (PubChem CID 23463769) has the molecular formula CHO6SZn+ and a molecular weight of 206.47 g/mol. Its IUPAC name is zinc sulfo carbonate.

Molecular Properties

Compound Namezinc sulfo carbonate
PubChem CID23463769
Molecular FormulaCHO6SZn+
Molecular Weight206.47 g/mol
Exact Mass204.88
IUPAC Namezinc sulfo carbonate
SMILESO=C([O-])OS(=O)(=O)O.[Zn+2]
InChIInChI=1S/CH2O6S.Zn/c2-1(3)7-8(4,5)6;/h(H,2,3)(H,4,5,6);/q;+2/p-1
InChIKeyBONNBXQMTFGLSR-UHFFFAOYSA-M
XLogP-1.85
TPSA103.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.47
LogP ≤ 5-1.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze zinc sulfo carbonate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

disulfo carbonate;bis(λ2-plumbane)
CID 173043440
tetralithium;disulfo carbonate;hydride
CID 174843261
sodium;hydride;sulfo acetate
CID 173308098
dicalcium;disulfo carbonate;hydride;zinc
CID 174696696
dicalcium;disulfo carbonate;hydride;manganese
CID 175398142
potassium;disodium;hydride;sulfo acetate;chloride;heptahydrate
CID 174241063
hydroxysilane;sulfo carbamate
CID 174435108
tricalcium;hydride;sulfo hydrogen carbonate;sulfuric acid
CID 175369181
magnesium;sulfuric acid;carbonate
CID 174916086
sodium 4-sulfooxycarbonylbenzoate
CID 88613260
phosphoric acid;sulfo hydrogen carbonate
CID 158348290
sodium 2-aminoethylsulfonyl carbonate
CID 174662764

Frequently Asked Questions

What is the IUPAC name of zinc sulfo carbonate?
The IUPAC name of zinc sulfo carbonate (CID 23463769) is zinc sulfo carbonate.
What is the SMILES notation for zinc sulfo carbonate?
The canonical SMILES for zinc sulfo carbonate is O=C([O-])OS(=O)(=O)O.[Zn+2].
What is the InChIKey of zinc sulfo carbonate?
The InChIKey is BONNBXQMTFGLSR-UHFFFAOYSA-M. The full InChI is InChI=1S/CH2O6S.Zn/c2-1(3)7-8(4,5)6;/h(H,2,3)(H,4,5,6);/q;+2/p-1.
What are the key properties of zinc sulfo carbonate?
zinc sulfo carbonate has a molecular weight of 206.47 g/mol, XLogP of -1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for zinc sulfo carbonate is sourced from PubChem (CID 23463769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).