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MFCD12546025 molecular structure
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(70Zn)zinc(2+) ion hydrate sulfate

ChemBase ID: 135756
Molecular Formular: H2O5SZn
Molecular Mass: 184.003199
Monoisotopic Mass: 183.88761316
SMILES and InChIs

SMILES:
O.[O-]S(=O)(=O)[O-].[70Zn+2]
Canonical SMILES:
[O-]S(=O)(=O)[O-].O.[70Zn+2]
InChI:
InChI=1S/H2O4S.H2O.Zn/c1-5(2,3)4;;/h(H2,1,2,3,4);1H2;/q;;+2/p-2/i;;1+5
InChIKey:
RNZCSKGULNFAMC-AFEATSGZSA-L

Cite this record

CBID:135756 http://www.chembase.cn/molecule-135756.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(70Zn)zinc(2+) ion hydrate sulfate
IUPAC Traditional name
(70Zn)zinc(2+) ion hydrate sulfate
Synonyms
Zinc-70Zn sulfate hydrate
硫酸锌水合物-70Zn
MDL Number
MFCD12546025
PubChem SID
162230029
PubChem CID
71309410

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
702625 external link Add to cart Please log in.
Data Source Data ID
PubChem 71309410 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -3.034349  H Acceptors
H Donor LogD (pH = 5.5) -5.569452 
LogD (pH = 7.4) -5.594027  Log P -0.841552 
Molar Refractivity 11.5274 cm3 Polarizability 6.037845 Å3
Polar Surface Area 80.26 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Mass Shift
M+6 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
3077 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
9 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
22-41-50/53 expand Show data source
Safety Statements
22-26-39-46-60-61 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS07 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H302-H318-H410 expand Show data source
GHS Precautionary statements
P273-P280-P305 + P351 + P338-P501 expand Show data source
RID/ADR
UN 3077 9/PG 3 expand Show data source
Purity
95% (CP) expand Show data source
Isotopic Purity
72 atom % (70Zn) expand Show data source
Mol. Weight
mol wt 164.72 by atom % calculation expand Show data source
Empirical Formula (Hill Notation)
70ZnSO4 · xH2O expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 702625 external link
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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