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13465-15-1 molecular structure
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indium(3+) ion octahydrate triperchlorate

ChemBase ID: 302831
Molecular Formular: Cl3H16InO20
Molecular Mass: 557.29204
Monoisotopic Mass: 555.83392895
SMILES and InChIs

SMILES:
O.O.O.O.O.O.O.O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[In+3]
Canonical SMILES:
[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.O.O.O.O.O.O.O.O.[In+3]
InChI:
InChI=1S/3ClHO4.In.8H2O/c3*2-1(3,4)5;;;;;;;;;/h3*(H,2,3,4,5);;8*1H2/q;;;+3;;;;;;;;/p-3
InChIKey:
XTGOEFBXGBSXJW-UHFFFAOYSA-K

Cite this record

CBID:302831 http://www.chembase.cn/molecule-302831.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
indium(3+) ion octahydrate triperchlorate
IUPAC Traditional name
indium(3+) ion octahydrate triperchlorate
Synonyms
Indium(III) perchlorate octahydrate
八水合高氯酸铟
CAS Number
13465-15-1
EC Number
236-874-7
MDL Number
MFCD00150241

DATA SOURCES

DATA SOURCES

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Data Source Data ID
Alfa Aesar 11642 external link Add to cart
Data Source Data ID Price
Alfa Aesar
11642 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Molar Refractivity 11.9079 cm3 Polarizability 5.355259 Å3
Polar Surface Area 74.27 Å2 Rotatable Bonds
Lipinski's Rule of Five false  Acid pKa -6.8919964 
H Acceptors H Donor
LogD (pH = 5.5) -2.4740524  LogD (pH = 7.4) -2.4740524 
Log P -0.097653694 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Crystalline expand Show data source
Melting Point
800°C expand Show data source
Storage Warning
Hygroscopic expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN1481 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
8-36/37/38 expand Show data source
Safety Statements
26 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H272-H315-H319-H335 expand Show data source
GHS Precautionary statements
P221-P210-P305+P351+P338-P302+P352-P405-P501A expand Show data source
Purity
99.9% (metals basis) expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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