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7789-02-8 molecular structure
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chromium(3+) ion nonahydrate trinitrate

ChemBase ID: 107981
Molecular Formular: CrH18N3O18
Molecular Mass: 400.14832
Monoisotopic Mass: 399.99904325
SMILES and InChIs

SMILES:
O.O.O.O.O.O.O.O.O.[Cr+3].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-]
Canonical SMILES:
[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].O.O.O.O.O.O.O.O.O.[Cr+3]
InChI:
InChI=1S/Cr.3NO3.9H2O/c;3*2-1(3)4;;;;;;;;;/h;;;;9*1H2/q+3;3*-1;;;;;;;;;
InChIKey:
GVHCUJZTWMCYJM-UHFFFAOYSA-N

Cite this record

CBID:107981 http://www.chembase.cn/molecule-107981.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
chromium(3+) ion nonahydrate trinitrate
chromium(3+) ion tris(nitrooxidane) nonahydrate
IUPAC Traditional name
chromium(3+) ion nonahydrate trinitrate
chromium(3+) nonahydrate trinitronate
Synonyms
Chromium(III) nitrate nonahydrate
CHROMIC NITRATE
硝酸铬(III) 九水合物
硝酸铬(III)九水合物
CAS Number
7789-02-8
EC Number
231-157-5
236-921-1
MDL Number
MFCD00149659
Merck Index
142226
PubChem SID
24863707
24858919
24854364
162089127
PubChem CID
9887206

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
H2O: very soluble expand Show data source
Soluble in water, alcohol expand Show data source
Apperance
crystalline expand Show data source
Crystalline expand Show data source
Melting Point
60 °C(lit.) expand Show data source
60°C expand Show data source
Density
1.80 g/mL(lit.) expand Show data source
RTECS
GB6300000 expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
Irritant Irritant (Xi) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
2720 expand Show data source
UN2720 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
3 expand Show data source
III expand Show data source
Risk Statements
8-36/38 expand Show data source
R:8-22 expand Show data source
Safety Statements
17-26-36 expand Show data source
17-26-37-60 expand Show data source
S:17-36/37/39 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H272-H315-H319 expand Show data source
H272-H315-H319-H303 expand Show data source
GHS Precautionary statements
P220-P305 + P351 + P338 expand Show data source
P221-P210-P305+P351+P338-P302+P352-P321-P501A expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 2720 5.1/PG 3 expand Show data source
Purity
≥97.0% (RT) expand Show data source
≥98.0% expand Show data source
≥99.99% trace metals basis expand Show data source
98.5% expand Show data source
99% expand Show data source
99.99% min (metals basis) expand Show data source
Grade
puriss. p.a. expand Show data source
purum p.a. expand Show data source
Certificate of Analysis
Download expand Show data source
Cation Traces
Ca: ≤50 mg/kg expand Show data source
Cd: ≤10 mg/kg expand Show data source
Cd: ≤50 mg/kg expand Show data source
Co: ≤50 mg/kg expand Show data source
Cu: ≤10 mg/kg expand Show data source
Cu: ≤50 mg/kg expand Show data source
Fe: ≤200 mg/kg expand Show data source
Fe: ≤700 mg/kg expand Show data source
K: ≤100 mg/kg expand Show data source
K: ≤50 mg/kg expand Show data source
Li: ≤200 mg/kg expand Show data source
Mg: ≤50 mg/kg expand Show data source
Na: ≤50 mg/kg expand Show data source
Na: ≤500 mg/kg expand Show data source
NH4+: ≤10 mg/kg expand Show data source
Ni: ≤50 mg/kg expand Show data source
Pb: ≤20 mg/kg expand Show data source
Pb: ≤50 mg/kg expand Show data source
Zn: ≤10 mg/kg expand Show data source
Zn: ≤50 mg/kg expand Show data source
Antion Traces
chloride (Cl-): ≤50 mg/kg expand Show data source
sulfate (SO42-): ≤200 mg/kg expand Show data source
sulfate (SO42-): ≤50 mg/kg expand Show data source
Linear Formula
Cr(NO3)3 · 9H2O expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05205662 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 379972 external link
Packaging
5 g in glass bottle
Sigma Aldrich - 239259 external link
Packaging
100, 500 g in poly bottle
2 kg in poly bottle
5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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