CHROMIUM (III) CHLORIDE CAS#: 10025-73-7; ChemWhat Code: 20038
Identification
Product Name | CHROMIUM (III) CHLORIDE |
IUPAC Name | trichlorochromium |
Molecular Structure | |
CAS Registry Number | 10025-73-7 |
EINECS Number | 233-038-3 |
MDL Number | MFCD00010948 |
Beilstein Registry Number | No data available |
Synonyms | chromium(III) chloridechromium trichloridechromium chloridechromic chlorideChromtrichloridchromium(III)chlorideChromium chloride |
Molecular Formula | CrCl3 |
Molecular Weight | 158.36 |
InChI | InChI=1S/3ClH.Cr/h3*1H;/q;;;+3/p-3 |
InChI Key | QSWDMMVNRMROPK-UHFFFAOYSA-K |
Canonical SMILES | [Cl-].[Cl-].[Cl-].[Cr+3] |
Patent Information | ||
Patent ID | Title | Publication Date |
EP1171445 | OLIGOMERISATION CATALYST | 2004 |
Physical Data
Appearance | Light yellow flaky solid |
Solubility | It is soluble in water as well as soluble in alcohol, benzene. |
Flash Point | 88 ºC |
Refractive index | 1.5560 (estimate) |
Sensitivity | Air Sensitive & Hygroscopic |
Melting Point, °C | Solvent (Melting Point) |
1150 |
Boiling Point, °C |
1150 |
1100 |
Density, g·cm-3 | Reference Temperature, °C | Measurement Temperature, °C |
2.61 | ||
2.349 – 3.03 | 25 | |
2.9156 |
Spectra
Description (NMR Spectroscopy) | Nucleus (NMR Spectroscopy) |
not given |
Description (IR Spectroscopy) | Solvent (IR Spectroscopy) |
Bands | KBr |
Spectrum | solid matrix |
Bands | solid |
Bands | gas |
Description (Mass Spectrometry) | Comment (Mass Spectrometry) |
Spectrum | Fragmentation pattern |
Molecular peak, Fragmentation pattern |
Description (UV/VIS Spectroscopy) | Solvent (UV/VIS Spectroscopy) | Comment (UV/VIS Spectroscopy) |
Spectrum, Band assignment | gas | 220 nm – 850 nm |
Spectrum, Band assignment | H2O | 200 nm – 700 nm |
Spectrum | H2O | 350 nm – 720 nm |
Band assignment | neat (no solvent) | 263.158 nm – 714.286 nm |
Spectrum | further solvent(s) | 434.783 nm – 1250 nm |
Route of Synthesis (ROS)
Conditions | Yield |
With catalyst: benzophenone; catalyst: THF; sodium High Pressure; at 150 °C and 210 at CO pressure; | 83.3% |
With catalyst: benzene; aluminium trichloride; aluminium High Pressure; at 140 °C and 150 – 200 at CO pressure; | 83% |
triethylaluminum High Pressure; at 110 – 115 °C and 246 at CO pressure; | 76% |
Safety and Hazards
Pictogram(s) | |
Signal | Danger |
GHS Hazard Statements | H302: Harmful if swallowed [Warning Acute toxicity, oral] H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318: Causes serious eye damage [Danger Serious eye damage/eye irritation] H401: Toxic to aquatic life [Hazardous to the aquatic environment, acute hazard] H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] Information may vary between notifications depending on impurities, additives, and other factors. |
Precautionary Statement Codes | P260, P264, P270, P273, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P391, P405, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.) |
Other Data
Transportation | NONH for all modes of transport |
Under the room temperature and away from light | |
HS Code | No data available |
Storage | Under the room temperature and away from light |
Shelf Life | 2 years |
Market Price | USD |
Druglikeness | |
Lipinski rules component | |
Molecular Weight | 158.355 |
HBA | 0 |
HBD | 0 |
Matching Lipinski Rules | 3 |
Veber rules component | |
Polar Surface Area (PSA) | 0 |
Rotatable Bond (RotB) | 0 |
Matching Veber Rules | 2 |
Use Pattern |
CHROMIUM (III) CHLORIDE CAS#: 10025-73-7 information on use |
strongly hygroscopic |
not hygroscopic |
CrCl3 soln. inert against Si2H6; |
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Warshel Chemical Ltd | http://www.warshel.com/ |
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