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Molecule
ID:128606
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
NbO₂
Molecular Mass
124.90518
Exact Mass
124.89620724
Charge
0
InChI
InChI=1S/Nb.2O
InChIKey
HFLAMWCKUFHSAZ-UHFFFAOYSA-N
Canonic Smiles
O=[Nb]=O
Isomeric Smiles
O=[Nb]=O
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-0.7028
LogD (pH = 7.4)
-0.7028
Log P
-0.7028
Molar Refractivity
2.8858
Polarizability
6.025566
Polar Surface Area
34.14
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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General Information
Calculated Properties
•
RDKit
•
JChem
Data Source
•
Academic Data
•
Commercial Catalog
Names and Identifiers
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IUPAC Traditional name
•
IUPAC name
•
Synonyms
Registration numbers
Properties
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Physical Property
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Safety Information
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Product Information
Related Proteins
Molecular Spectra
Molecule Details
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Wikipedia
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Sigma Aldrich
References
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Academic Data
Wikipedia
Niobium_dioxide
PubChem
82839
Commercial Catalog
Sigma Aldrich
383163
Names and Identifiers
IUPAC Traditional name
niobium dioxide
IUPAC name
dioxoniobium
Synonyms
Niobium dioxide
columbium dioxide
niobium(IV) oxide
氧化铌(IV)
Niobium(IV) oxide
Registration numbers
EC Number
234-809-7
CAS Number
12034-59-2
PubChem CID
82839
Wikipedia Title
Niobium_dioxide
MDL Number
MFCD00016242
PubChem SID
24863943
162222913
Properties
Physical Property
Apperance
bluish black
Source
powder
Source
Melting Point
1915 °C
Source
Density
5.9 g/mL at 25 °C(lit.)
Source
Safety Information
GHS Hazard statements
H315
-
H319
-
H335
Source
GHS Pictograms
Acute toxicity (oral, dermal, inhalation), category 4
Skin irritation, category 2
Eye irritation, category 2
Skin sensitisation, category 1
Specific Target Organ Toxicity – Single exposure, category 3
Source
GHS Signal Word
Warning
Source
GHS Precautionary statements
P261
-
P305+P351+P338
Source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Source
Safety Statements
26
-
37/39
Source
European Hazard Symbols
Irritant (Xi)
Source
MSDS Link
Download link
Source
Risk Statements
36/37/38
Source
German water hazard class
3
Source
Product Information
Linear Formula
NbO2
Source
Purity
99.9% trace metals basis
Source
Molecule Details
Wikipedia
Niobium_dioxide
Sigma Aldrich
383163
Packaging
5 g in glass bottle
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Registration numbers
•
EC Number
•
CAS Number
•
PubChem CID
•
Wikipedia Title
•
MDL Number
•
PubChem SID