hexachlorostibanuide; triphenylmethylium

• ChemBase ID: 137535
• Molecular Formular: C19H15Cl6Sb
• Molecular Mass: 577.8004
• Monoisotopic Mass: 573.83430656
• SMILES: c1ccc(cc1)[C+](c1ccccc1)c1ccccc1.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl
• Canonical SMILES: c1ccc(cc1)[C+](c1ccccc1)c1ccccc1.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl
• InChI: InChI=1S/C19H15.6ClH.Sb/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;;;;/h1-15H;6*1H;/q+1;;;;;;;+5/p-6
• InChIKey: GASWLBDVMZXHOP-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: hexachlorostibanuide; triphenylmethylium
• IUPAC Traditional name: hexachlorostibanuide; triphenylmethylium
• Synonyms: Triphenylcarbenium hexachloroantimonate; Trityl hexachloroantimonate; Tritylium hexachloroantimonate; Tritylium hexachloroantimonate; Triphenylcarbenium hexachloroantimonate; 三苯甲基六氯锑酸盐; 六氯锑酸三苯基碳鎓; 三苯基六氯锑酸碳

Database IDs

• CAS Number: 1586-91-0
• EC Number: 216-446-6
• MDL Number: MFCD00013126
• Beilstein Number: 3817547
• PubChem SID: 162231797
• PubChem CID: 16688166

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.030707
• LogD (pH = 7.4): 2.030707
• Log P: 2.030707
• Molar Refractivity: 79.5869 cm^3
• Polarizability: 31.464106 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 218 °C (dec.); ca 220°C dec.

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C); Nature polluting (N); X; Harmful (Xn)
• UN Number: 3261; UN3261
• German water hazard class: 2
• Hazard Class: 8
• Packing Group: 2; II
• Risk Statements: 20/22-34-51/53; 20/22-51/53
• Safety Statements: 26-36/37/39-45-61; 61
• TSCA Listed: 是
• GHS Pictograms: GHS05; GHS07; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H332-H411; H314-H318-H302-H332-H411-H401
• GHS Precautionary statements: P273; P280-P273-P303+P361+P353-P305+P351+P338-P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves
• RID/ADR: UN 3261 8/PG 2

Product Information

• Purity: 99%
• Linear Formula: (C6H5)3C(SbCl6)

REFERENCES

• Lewis acid catalyst which promotes the reactions of silyl ketene acetals with various electrophiles: Bull. Chem. Soc.Jpn., 63, 1898 (1990); Helv. Chim. Acta, 70, 448 (1987); Chem. Lett., 889 (1990).