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7727-18-6 molecular structure
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vanadium(5+) ion trichloride oxidandiide

ChemBase ID: 303869
Molecular Formular: Cl3OV
Molecular Mass: 173.2999
Monoisotopic Mass: 171.84543216
SMILES and InChIs

SMILES:
[O-2].[Cl-].[Cl-].[Cl-].[V+5]
Canonical SMILES:
[O-2].[Cl-].[Cl-].[Cl-].[V+5]
InChI:
InChI=1S/3ClH.O.V/h3*1H;;/q;;;-2;+5/p-3
InChIKey:
HLDPWJREWQOPAV-UHFFFAOYSA-K

Cite this record

CBID:303869 http://www.chembase.cn/molecule-303869.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
vanadium(5+) ion trichloride oxidandiide
IUPAC Traditional name
vanadium(5+) ion trichloride oxidandiide
Synonyms
Vanadium oxytrichloride
Vanadyl trichloride
Vanadium(V) trichloride oxide
三氯代氧化钒(V), V?
CAS Number
7727-18-6
EC Number
231-780-2
MDL Number
MFCD00011459
Merck Index
149927

DATA SOURCES

DATA SOURCES

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Data Source Data ID
Alfa Aesar 81118 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.7  H Acceptors
H Donor LogD (pH = 5.5) -0.652 
LogD (pH = 7.4) -0.652  Log P -0.652 
Molar Refractivity 13.1149 cm3 Polarizability 1.8190874 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
Liquid expand Show data source
Melting Point
-77°C expand Show data source
Boiling Point
126-127°C expand Show data source
Density
1.829 expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
UN Number
UN2443 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
II expand Show data source
Risk Statements
14-25-34 expand Show data source
Safety Statements
8-26-28-30-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS Hazard statements
H300-H314-H318 expand Show data source
GHS Precautionary statements
P260-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Purity
V+5 28.5% min expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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