trichloroiron

• ChemBase ID: 103901
• Molecular Formular: Cl3Fe
• Molecular Mass: 162.204
• Monoisotopic Mass: 160.84149554
• SMILES: Cl[Fe](Cl)Cl
• Canonical SMILES: Cl[Fe](Cl)Cl
• InChI: InChI=1S/3ClH.Fe/h3*1H;/q;;;+3/p-3
• InChIKey: RBTARNINKXHZNM-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trichloroiron
• IUPAC Traditional name: ferric chloride
• Synonyms: trichloroiron; Iron Chloride; FERRIC CHLORIDE, ANHYDROUS; Ferric chloride solution; Iron(III) chloride solution; Iron(III) chloride; Chlorure Perrique; Iron (III) Chloride; Iron Trichloride; Perchlorure de Fer; FERRIC CHLORIDE; Ferric chloride; Molysite; Flores martis; Iron(III) chloride; Iron atomic spectroscopy standard concentrate 10.00 g Fe; Iron atomic spectroscopy standard concentrate 1.00 g Fe; Iron(III) chloride solution; Tryptophan Deaminase Reagent; TDA Reagent; Ferric chloride on silica gel; Iron(III) chloride on silica gel; 氯化铁 溶液; 三氯化铁 溶液; 氯化铁; 氯化铁(III); 三氯化铁; 铁标准浓缩液 10.00g Fe; 铁原子光谱分析标准浓缩液 1.00g Fe; 三氯化铁 溶液; 色氨酸脱氨酶试剂; TDA 试剂; 硅胶负载氯化铁; 硅胶负载三氯化铁

Database IDs

• CAS Number: 7705-08-0
• EC Number: 231-096-4; 231-729-4
• MDL Number: MFCD00011005
• PubChem SID: 162091653; 24845467; 24845365; 24847528; 24868641; 24849697; 24862014; 24868472
• PubChem CID: 24380
• CHEBI ID: 30808
• Chemspider ID: 22792
• Wikipedia Title: Iron(III)_chloride

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.3035
• LogD (pH = 7.4): 2.3035
• Log P: 2.3035
• Molar Refractivity: 18.4089 cm^3
• Polarizability: 10.17752 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: 63 g/100 ml (18 °C); highly soluble; 83 g/100 ml; highly soluble in acetone; Methanol; Ethanol; Diethyl ether; 74.4 g/100 mL (0 °C) ; 92 g/100 mL (hexahydrate, 20 °C) in water; H2O: soluble
• Apperance: green-black by reflected light; purple-red by transmitted light; hexahydrate: yellow solid; aq. solutions: brown; powder
• Melting Point: 304 °C(lit.); 306 °C; 306 °C (anhydrous) ; 37 °C (hexahydrate); 306°C
• Boiling Point: 315 °C; 315 °C (anhydrous, decomp) ; 280 °C (hexahydrate, decomp) (partial decomposition to FeCl₂ + Cl₂); 315°C
• Flash Point: 10 °F; -12 °C; non-flammable
• Density: 0.868 g/mL at 25 °C; 2.898 g/cm^3 (anhydrous) ; 1.82 g/cm^3 (hexahydrate); 2.898 g/cm^3 at 25 °C
• Refractive Index: n20/D 1.414
• Vapor Pressure: 1 mmHg ( 194 °C); 1.33 hPa at 25 °C
• Vapor Density: 5.61 (vs air)
• Hydrophobicity(logP): -1.316
• Viscosity: 40% solution: 12 cP
• Odor: slight HCl

Safety Information

• Storage Condition: Room Temperature (15-30°C), Desiccate, Store Under Nitrogen
• RTECS: LJ9100000
• European Hazard Symbols: Corrosive (C); Flammable (F); Irritant (Xi); Harmful (Xn)
• UN Number: 1773; 1773 (anhydrous); 2582 (aq. soln.); 2536; 2582
• German water hazard class: 1; 3
• Hazard Class: 3; 8
• Packing Group: 2; 3; III
• Australian Hazchem: 2X
• Risk Statements: 11-19; 22-38-41; 36; 38-41; 41; R:34; R:36/37/38
• Safety Statements: 16-23; 26; 26-39; S:20-25-26-37/39; S:26-27/28-36/37/39-46-64
• EU Classification: C10
• EU Hazard Identification Number: 8B
• Emergency Response Guidebook(ERG) Number: 157
• EU Index: listed
• GHS Pictograms: GHS05; : Corr. Met. 1; Skin Corr. 1C; Eye Dam. 1; GHS07; : Acute Tox. 4 (oral); GHS09
• GHS Signal Word: DANGER; Danger
• NFPA704:
  

  0

  2

  0
• GHS Hazard statements: 290, 302, 314, 318; H290-H302-H315-H318-H411; H290-H315-H318-H411; H290-H318-H412; H315-H318; H318-H412
• GHS Precautionary statements: 234, 260, 264, 270, 273, 280, 301+312, 301+330+331, 303+361+353, 363, 304+340, 310, 321, 305+351+338, 390, 405, 406, 501; P273-P280-P305 + P351 + P338; P280-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves; Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter; Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1773 8/PG 3; UN 2536 3/PG 2; UN 2582 8/PG 3

Product Information

• Purity: ≥97.0% (RT); ≥98%; ≥99.9% trace metals basis; ≥99.99% trace metals basis; 45% FeCl3 basis; 95%; 97%
• Concentration: 0.2 M in 2-methyltetrahydrofuran; 1.00 g/L; 10.00 g/L; 38%
• Grade: anhydrous; CP; for microbiology; purum; reagent grade; sublimed grade
• Compostion: ferric chloride, 1 g/10 mL (in distilled water)
• Suitability: in accordance for identity
• Impurities: ≤1% insoluble in water
• Cation Traces: As: ≤20 mg/kg; Cu: ≤1000 mg/kg; Fe2+: ≤2000 mg/kg; Mn: ≤3000 mg/kg; Ni: ≤500 mg/kg; Pb: ≤200 mg/kg; Zn: ≤1000 mg/kg
• Shelf Life: (limited shelf life, expiry date on the label)
• Extent of Labeling: ~0.4 mmol/g FeCl3 loading; 5 wt. % loading
• Quality: ampule; anhydrous
• Linear Formula: FeCl3
• Empirical Formula (Hill Notation): Cl3Fe

DETAILS

MP Biomedicals - 02153499

Anhydrous

Sigma Aldrich - 710857

Application
Used as mild oxidant for phenolic coupling, dimerizing aryllithiumsand ketone enolates; also used as mild Lewis acid to catalyzes enereactions, Nazarov cyclizations, Michael additions, andacetonations
Packaging
50 mL in Sure/Seal™

Sigma Aldrich - 361003

Packaging
25 g in poly bottle

Sigma Aldrich - 451649

Packaging
1, 5 g in ampule
Application
The vapor-phase co-reductions with other metal halides by hydrogen results in finely divided intermetallics with applications as structural materials or compounds with useful thermoelectric, magnetic, and oxidation-resitance properties.

Sigma Aldrich - 701122

Packaging
1, 5, 25 g in glass bottle
Application
The vapor-phase co-reductions with other metal halides by hydrogen results in finely divided intermetallics with applications as structural materials or compounds with useful thermoelectric, magnetic, and oxidation-resitance properties.

Sigma Aldrich - 03376

Preparation Note
prepared with FeCl3.6H2O and H2O
Reconstitution
When diluting, acidify with HCl or H2SO4.

Sigma Aldrich - 80353

Application
For identification of Proteus species by detection of tryptophan deaminase activity.

Sigma Aldrich - 44937

Other Notes
Supported reagent for the dehydration of various alcohols1; For oxidative coupling reactions and as Lewis acid2,3,4

Sigma Aldrich - 02679

Preparation Note
prepared with FeCl3.6H2O, HCl and H2O
Reconstitution
Dilute the ampule to approx. 850 mL with water. Carefully add 100 mL conc. HCl to acidify. Bring to volume with water.

Sigma Aldrich - 157740

Packaging
1 kg in poly bottle
5 g in glass bottle
100 g in poly bottle
6×1 kg in glass bottle
Application
The vapor-phase co-reductions with other metal halides by hydrogen results in finely divided intermetallics with applications as structural materials or compounds with useful thermoelectric, magnetic, and oxidation-resitance properties.

Sigma Aldrich - 15-1190

Application
The vapor-phase co-reductions with other metal halides by hydrogen results in finely divided intermetallics with applications as structural materials or compounds with useful thermoelectric, magnetic, and oxidation-resitance properties.