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13986-26-0 molecular structure
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tetraiodozirconium

ChemBase ID: 130258
Molecular Formular: I4Zr
Molecular Mass: 598.84188
Monoisotopic Mass: 597.522596
SMILES and InChIs

SMILES:
I[Zr](I)(I)I
Canonical SMILES:
I[Zr](I)(I)I
InChI:
InChI=1S/4HI.Zr/h4*1H;/q;;;;+4/p-4
InChIKey:
XLMQAUWIRARSJG-UHFFFAOYSA-J

Cite this record

CBID:130258 http://www.chembase.cn/molecule-130258.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetraiodozirconium
IUPAC Traditional name
tetraiodozirconium
Synonyms
Zirconium(IV) iodide
zirconium tetraiodide
Zirconium(IV) iodide
碘化锆(IV)
CAS Number
13986-26-0
EC Number
237-780-9
MDL Number
MFCD00049641
PubChem SID
24864930
162224538
PubChem CID
518853
Chemspider ID
75903
Wikipedia Title
Zirconium(IV)_iodide

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
400572 external link Add to cart Please log in.

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.7344  LogD (pH = 7.4) 3.7344 
Log P 3.7344  Molar Refractivity 53.3632 cm3
Polarizability 27.888374 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
soluble in water expand Show data source
Apperance
orange-yellow crystalline
hygroscopic
expand Show data source
powder expand Show data source
Melting Point
499 °C
(triple point)
expand Show data source
Boiling Point
431 °C (sublimes) expand Show data source
Density
4.580 g/cm3, solid expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
3260 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
34 expand Show data source
Safety Statements
22-26-27-36/37/39-45 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
NFPA704
NFPA 704 diagram
0
3
2
expand Show data source
GHS Hazard statements
H314 expand Show data source
GHS Precautionary statements
P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 3260 8/PG 2 expand Show data source
Purity
99.9% trace metals basis expand Show data source
Grade
anhydrous expand Show data source
Linear Formula
ZrI4 expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 400572 external link
Packaging
1, 5 g in ampule

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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