Home > Compound List > Compound details
13859-51-3 molecular structure
click picture or here to close

pentaazaniumyl(chloro)cobalttriuide dichloride

ChemBase ID: 302978
Molecular Formular: Cl3CoH15N5
Molecular Mass: 250.4448
Monoisotopic Mass: 248.97249855
SMILES and InChIs

SMILES:
[Co-3]([NH3+])([NH3+])([NH3+])(Cl)([NH3+])[NH3+].[Cl-].[Cl-]
Canonical SMILES:
Cl[Co-3]([NH3+])([NH3+])([NH3+])([NH3+])[NH3+].[Cl-].[Cl-]
InChI:
InChI=1S/3ClH.Co.5H3N/h3*1H;;5*1H3/q;;;+3;;;;;/p-3
InChIKey:
NSYALVBBDKTCLE-UHFFFAOYSA-K

Cite this record

CBID:302978 http://www.chembase.cn/molecule-302978.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
pentaazaniumyl(chloro)cobalttriuide dichloride
IUPAC Traditional name
pentaammonio(chloro)cobalttriuide dichloride
Synonyms
Pentaamminechlorocobalt(III) chloride
Chloropentaamminecobalt(III) chloride
氯化五氨氯合钴(III)
CAS Number
13859-51-3
EC Number
237-594-8
MDL Number
MFCD00064728

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 13765 external link Add to cart
Data Source Data ID Price
Alfa Aesar
13765 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -6.341185  LogD (pH = 7.4) -3.437011 
Log P -1.4595  Molar Refractivity 83.7108 cm3
Polarizability 14.715104 Å3 Polar Surface Area 138.2 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Solubility
Slightly soluble in water, soluble in conc. H2SO4. Insoluble in alcohol expand Show data source
Apperance
Powder expand Show data source
Melting Point
dec. expand Show data source
Density
1.819 expand Show data source
European Hazard Symbols
X expand Show data source
Risk Statements
40-43 expand Show data source
Safety Statements
24-36/37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS08 expand Show data source
GHS Hazard statements
H351-H317 expand Show data source
GHS Precautionary statements
P280H-P262 expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle