Home > Compound List > Compound details
13138-45-9 molecular structure
click picture or here to close

nickel(2+) ion bis(nitrooxidane)

ChemBase ID: 128593
Molecular Formular: N2NiO6
Molecular Mass: 182.7032
Monoisotopic Mass: 181.91097863
SMILES and InChIs

SMILES:
[Ni+2].[O-][N+](=O)[O-].[O-][N+](=O)[O-]
Canonical SMILES:
[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Ni+2]
InChI:
InChI=1S/2NO3.Ni/c2*2-1(3)4;/q2*-1;+2
InChIKey:
KBJMLQFLOWQJNF-UHFFFAOYSA-N

Cite this record

CBID:128593 http://www.chembase.cn/molecule-128593.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
nickel(2+) ion bis(nitrooxidane)
nickel(2+) ion dinitrate
IUPAC Traditional name
nickel(2+) ion dinitronate
nickel(2+) ion dinitrate
Synonyms
Nickel nitrate, Matrix Modifier Solution, Specpure®
Nickel nitrate
Nickelous nitrate
Nitric acid, nickel(2+) salt
Nickel(II) nitrate
Nickel(II) nitrate hexahydrate
硝酸镍,基质改性溶液, Specpure®
硝酸镍(II)六水合物
CAS Number
13138-45-9
13478-00-7
EC Number
238-076-4
236-068-5
231-714-2
MDL Number
MFCD00011139
MFCD00149805
Merck Index
146513
PubChem SID
162222900
PubChem CID
25736
Chemspider ID
23976
Wikipedia Title
Nickel(II)_nitrate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -1.3999903  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)
Solubility
94.2 g/100ml (20 °C)
158 g/100ml (60 °C) in water
expand Show data source
soluble in ethanol expand Show data source
Apperance
emerald green hygroscopic solid expand Show data source
Liquid expand Show data source
Melting Point
56.7 °C (hexahydrate) expand Show data source
56.7°C expand Show data source
Boiling Point
136.7 °C (hexahydrate) expand Show data source
137°C expand Show data source
Flash Point
Non-flammable expand Show data source
Density
2.05 expand Show data source
2.05 g/cm3 (hexahydrate) expand Show data source
Refractive Index
1.422 (hexahydrate) expand Show data source
Odor
odorless expand Show data source
Storage Warning
Hygroscopic expand Show data source
RTECS
QR7300000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Carc. Cat. 1 expand Show data source
Dangerous for the environment (N) expand Show data source
Harmful (Xn) expand Show data source
Irritant (Xi) expand Show data source
Muta. Cat. 3 expand Show data source
Nature polluting Nature polluting (N) expand Show data source
Oxidising Oxidising (O) expand Show data source
Oxidant (O) expand Show data source
Repr. Cat. 2 expand Show data source
Toxic Toxic (T) expand Show data source
Toxic (T) expand Show data source
UN Number
UN2725 expand Show data source
UN3264 expand Show data source
Hazard Class
5.1 expand Show data source
8 expand Show data source
Packing Group
III expand Show data source
Risk Statements
34 expand Show data source
49-61-8-20/22-38-41-42/43-48/23-68-50/53 expand Show data source
R49, R61, R8, R20/22, R38, R41, R42/43, R48/23, R68, R50/53 expand Show data source
Safety Statements
23-26-36/37/39-45 expand Show data source
53-45-60-61 expand Show data source
S53, S45, S60, S61 expand Show data source
TSCA Listed
expand Show data source
EU Index
028-012-00-1 expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS05 expand Show data source
GHS07 expand Show data source
GHS08 expand Show data source
GHS09 expand Show data source
NFPA704
NFPA 704 diagram
0
2
0
OX
expand Show data source
LD50
1620 mg/kg (oral, rat) expand Show data source
GHS Hazard statements
H272-H334-H350-H360-H372-H317-H341-H318-H315-H400-H410-H302-H332 expand Show data source
H314-H318 expand Show data source
GHS Precautionary statements
P221-P273-P201-P308+P313-P501A expand Show data source
P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A expand Show data source
Purity
98% expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

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