zinc;azane;carbonate

CH3NO3Zn — CID 14029939

IUPACzinc;azane;carbonate
SMILESN.O=C([O-])[O-].[Zn+2]
InChIInChI=1S/CH2O3.H3N.Zn/c2-1(3)4;;/h(H2,2,3,4);1H3;/q;;+2/p-2
InChIKeyCUHLTWOGTOCQBK-UHFFFAOYSA-L
MW142.43 g/mol
LogP-2.29
Rot. Bonds

About zinc;azane;carbonate

zinc;azane;carbonate (PubChem CID 14029939) has the molecular formula CH3NO3Zn and a molecular weight of 142.43 g/mol. Its IUPAC name is zinc;azane;carbonate.

Molecular Properties

Compound Namezinc;azane;carbonate
PubChem CID14029939
Molecular FormulaCH3NO3Zn
Molecular Weight142.43 g/mol
Exact Mass140.94
IUPAC Namezinc;azane;carbonate
SMILESN.O=C([O-])[O-].[Zn+2]
InChIInChI=1S/CH2O3.H3N.Zn/c2-1(3)4;;/h(H2,2,3,4);1H3;/q;;+2/p-2
InChIKeyCUHLTWOGTOCQBK-UHFFFAOYSA-L
XLogP-2.29
TPSA98.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.43
LogP ≤ 5-2.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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bis(rhodium(3+));tricarbonate
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CID 141056250
azane;carbonic acid;zirconium(4+);dicarbonate
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zinc;azane;carbonic acid;hydrogen carbonate
CID 174841171

Frequently Asked Questions

What is the IUPAC name of zinc;azane;carbonate?
The IUPAC name of zinc;azane;carbonate (CID 14029939) is zinc;azane;carbonate.
What is the SMILES notation for zinc;azane;carbonate?
The canonical SMILES for zinc;azane;carbonate is N.O=C([O-])[O-].[Zn+2].
What is the InChIKey of zinc;azane;carbonate?
The InChIKey is CUHLTWOGTOCQBK-UHFFFAOYSA-L. The full InChI is InChI=1S/CH2O3.H3N.Zn/c2-1(3)4;;/h(H2,2,3,4);1H3;/q;;+2/p-2.
What are the key properties of zinc;azane;carbonate?
zinc;azane;carbonate has a molecular weight of 142.43 g/mol, XLogP of -2.29, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;azane;carbonate is sourced from PubChem (CID 14029939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).