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865-44-1 molecular structure
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trichloro-λ3-iodane

ChemBase ID: 127836
Molecular Formular: Cl3I
Molecular Mass: 233.26347
Monoisotopic Mass: 231.81103104
SMILES and InChIs

SMILES:
Cl[I](Cl)Cl
Canonical SMILES:
Cl[I](Cl)Cl
InChI:
InChI=1S/Cl3I/c1-4(2)3
InChIKey:
PAWIVBWALDNUJP-UHFFFAOYSA-N

Cite this record

CBID:127836 http://www.chembase.cn/molecule-127836.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trichloro-λ3-iodane
IUPAC Traditional name
iodine trichloride
trichloro-λ3-iodane
Synonyms
Iodine trichloride
Iodine trichloride
三氯化碘
CAS Number
865-44-1
EC Number
212-739-8
MDL Number
MFCD00036291
PubChem SID
24862052
162222154
PubChem CID
70076
Chemspider ID
63265
Wikipedia Title
Iodine_trichloride

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.3044906  LogD (pH = 7.4) 2.3044906 
Log P 2.3044906  Molar Refractivity 31.7497 cm3
Polarizability 12.933488 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
yellow solid expand Show data source
Melting Point
63 °C expand Show data source
Density
3.11 g/cm3 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Oxidising Oxidising (O) expand Show data source
UN Number
3085 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
34 expand Show data source
9-34 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H272-H314 expand Show data source
GHS Precautionary statements
P220-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 3085 5.1/PG 2 expand Show data source
Storage Temperature
-20°C expand Show data source
Purity
≥96.0% expand Show data source
≥97.0% expand Show data source
97% expand Show data source
Grade
SAJ first grade expand Show data source
SAJ special grade expand Show data source
Linear Formula
ICl3 expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 359122 external link
Packaging
50 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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