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38218-24-5 molecular structure
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indium(3+) ion tris(propan-2-olate)

ChemBase ID: 303652
Molecular Formular: C9H21InO3
Molecular Mass: 292.07924
Monoisotopic Mass: 292.05294753
SMILES and InChIs

SMILES:
CC(C)[O-].CC(C)[O-].CC(C)[O-].[In+3]
Canonical SMILES:
[O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[In+3]
InChI:
InChI=1S/3C3H7O.In/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
InChIKey:
OVZUSPADPSOQQN-UHFFFAOYSA-N

Cite this record

CBID:303652 http://www.chembase.cn/molecule-303652.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
indium(3+) ion tris(propan-2-olate)
IUPAC Traditional name
indium(3+) ion tris(propan-2-olate)
Synonyms
Indium(III) isopropoxide
异丙醇铟(III)
CAS Number
38218-24-5
MDL Number
MFCD00210318

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 44562 external link Add to cart 42098 external link Add to cart
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 17.262587  H Acceptors
H Donor LogD (pH = 5.5) 0.2548059 
LogD (pH = 7.4) 0.25480592  Log P 0.25480592 
Molar Refractivity 27.979 cm3 Polarizability 6.5838666 Å3
Polar Surface Area 23.06 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Liquid expand Show data source
Powder, Packaged under argon expand Show data source
Melting Point
145°C dec. expand Show data source
Boiling Point
82°C expand Show data source
Flash Point
12°C(54°F) expand Show data source
Density
0.78 expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN1219 expand Show data source
UN3181 expand Show data source
Hazard Class
3 expand Show data source
4.1 expand Show data source
Packing Group
II expand Show data source
III expand Show data source
Risk Statements
11-36/37/38 expand Show data source
11-36/38-67 expand Show data source
Safety Statements
16-26-37 expand Show data source
7/9-16-24/25-26-33-37-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H225-H319-H336 expand Show data source
H228-H315-H319-H335 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
P210-P280G-P305+P351+P338-P337+P313 expand Show data source
Purity
99.9% (metals basis) expand Show data source
99+% (metals basis), 5% w/v isopropanol expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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