zinc;icosahydrate

H40O20Zn10 — CID 173373032

IUPACzinc;icosahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn]
InChIInChI=1S/20H2O.10Zn/h20*1H2;;;;;;;;;;
InChIKeyPTJILJDYIOOAKI-UHFFFAOYSA-N
MW1014.20 g/mol
LogP-16.52
Rot. Bonds

About zinc;icosahydrate

zinc;icosahydrate (PubChem CID 173373032) has the molecular formula H40O20Zn10 and a molecular weight of 1014.20 g/mol. Its IUPAC name is zinc;icosahydrate.

Molecular Properties

Compound Namezinc;icosahydrate
PubChem CID173373032
Molecular FormulaH40O20Zn10
Molecular Weight1014.20 g/mol
Exact Mass999.50
IUPAC Namezinc;icosahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn]
InChIInChI=1S/20H2O.10Zn/h20*1H2;;;;;;;;;;
InChIKeyPTJILJDYIOOAKI-UHFFFAOYSA-N
XLogP-16.52
TPSA630.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001014.20
LogP ≤ 5-16.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 172768503
zinc;nonahydrate
CID 173423930
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CID 173320824
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CID 11276481
λ2-stannane;zinc;dihydrate
CID 173115976
iron;zinc;dihydrate
CID 173247580
zinc;dihydrate;tetrahydrochloride
CID 173200157
CID 25109055
CID 25109055
copper;nickel;zinc;dihydrate
CID 175965356
oxidane
CID 173081003
cadmium;λ2-stannane;zinc;hydrate
CID 173331582
alumane;λ2-stannane;zinc;trihydrate
CID 174917482

Frequently Asked Questions

What is the IUPAC name of zinc;icosahydrate?
The IUPAC name of zinc;icosahydrate (CID 173373032) is zinc;icosahydrate.
What is the SMILES notation for zinc;icosahydrate?
The canonical SMILES for zinc;icosahydrate is O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].
What is the InChIKey of zinc;icosahydrate?
The InChIKey is PTJILJDYIOOAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/20H2O.10Zn/h20*1H2;;;;;;;;;;.
What are the key properties of zinc;icosahydrate?
zinc;icosahydrate has a molecular weight of 1014.20 g/mol, XLogP of -16.52, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;icosahydrate is sourced from PubChem (CID 173373032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).