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638-39-1 molecular structure
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tin(4+) ion diacetate dihydride

ChemBase ID: 178659
Molecular Formular: C4H6O4Sn++
Molecular Mass: 236.78904
Monoisotopic Mass: 237.92880267
SMILES and InChIs

SMILES:
[Sn+4].[O-]C(=O)C.[O-]C(=O)C
Canonical SMILES:
[O-]C(=O)C.[O-]C(=O)C.[Sn+4]
InChI:
InChI=1S/2C2H4O2.Sn/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+4/p-2
InChIKey:
BCHNAWAIRDXOOE-UHFFFAOYSA-L

Cite this record

CBID:178659 http://www.chembase.cn/molecule-178659.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tin(4+) ion diacetate dihydride
IUPAC Traditional name
tin(4+) ion diacetate dihydride
Synonyms
Acetic Acid Tin(2+) Salt
Tin Acetate (Sn(OAc)2)
Stannous Acetate
Tin Acetate
Tin Acetate (Sn(MeCO2)2)
Tin acetate (Sn(O2C2H3)2)
Tin diacetate
Tin(II) Acetate
Tin(II) Acetate
CAS Number
638-39-1
PubChem SID
164234569
PubChem CID
71752582

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
TRC T444080 external link Add to cart
PubChem 71752582 external link
Data Source Data ID Price
TRC
T444080 external link Add to cart Please log in.
Data Source Data ID
PubChem 71752582 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 4.54344  H Acceptors
H Donor LogD (pH = 5.5) -1.2242727 
LogD (pH = 7.4) -2.9968748  Log P -0.22334571 
Molar Refractivity 23.4808 cm3 Polarizability 4.912116 Å3
Polar Surface Area 40.13 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
DMSO expand Show data source
Methanol expand Show data source
Apperance
White Solid expand Show data source
Melting Point
>213°C (dec.) expand Show data source
Storage Condition
Refrigerator, Under Inert Atmosphere expand Show data source
MSDS Link
Download expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - T444080 external link
Tin(II) Acetate is used in stannous oral care compositions.

REFERENCES

REFERENCES

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  • • Surerus, K., et al.: Biochemistry, 1994, 33, 4980 (1994)
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PATENTS

PATENTS

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INTERNET

INTERNET

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