Home > Compound List > Compound details
13778-31-9 molecular structure
click picture or here to close

copper(2+) ion hexahydrate dinitrate

ChemBase ID: 302746
Molecular Formular: CuH12N2O12
Molecular Mass: 295.64748
Monoisotopic Mass: 294.96862133
SMILES and InChIs

SMILES:
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Cu+2]
Canonical SMILES:
[O-][N+](=O)[O-].[O-][N+](=O)[O-].O.O.O.O.O.O.[Cu+2]
InChI:
InChI=1S/Cu.2NO3.6H2O/c;2*2-1(3)4;;;;;;/h;;;6*1H2/q+2;2*-1;;;;;;
InChIKey:
FTXJFNVGIDRLEM-UHFFFAOYSA-N

Cite this record

CBID:302746 http://www.chembase.cn/molecule-302746.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
copper(2+) ion hexahydrate dinitrate
IUPAC Traditional name
copper(2+) ion hexahydrate dinitrate
Synonyms
Copper(II) nitrate hydrate, Puratronic®
水合硝酸铜(II), Puratronic®
CAS Number
13778-31-9
EC Number
221-838-5
MDL Number
MFCD00149669
Merck Index
142643

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 10699 external link Add to cart
Data Source Data ID Price
Alfa Aesar
10699 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) 0.8368004  LogD (pH = 7.4) 0.8368004 
Log P 0.8368004  Molar Refractivity 8.3471 cm3
Polarizability 3.4222581 Å3 Polar Surface Area 66.2 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Crystalline Aggregates expand Show data source
Storage Warning
Hygroscopic expand Show data source
RTECS
GL7875000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Oxidising Oxidising (O) expand Show data source
X expand Show data source
UN Number
UN3085 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
III expand Show data source
Risk Statements
8-22-34 expand Show data source
Safety Statements
17-26-36/37/39-45-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS05 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H272-H314-H318-H302 expand Show data source
GHS Precautionary statements
P221-P210-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Purity
99.999% (metals basis) 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