Purity | Size | Price | VIP Price | USA Stock *0-1 Day | Global Stock *5-7 Days | Quantity | |||||
{[ item.p_purity ]} | {[ item.pr_size ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} | Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]} | {[ item.pr_usastock ]} | Inquiry - | {[ item.pr_chinastock ]} | Inquiry - |
* Storage: {[proInfo.prStorage]}
CAS No. : | 64443-05-6 | MDL No. : | MFCD00064810 |
Formula : | C8H12CuF6N4P | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | GNQXUMGHBSAQBV-UHFFFAOYSA-N |
M.W : | 372.72 | Pubchem ID : | 11068737 |
Synonyms : |
|
Signal Word: | Warning | Class: | N/A |
Precautionary Statements: | P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313 | UN#: | N/A |
Hazard Statements: | H315-H319 | Packing Group: | N/A |
GHS Pictogram: |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
36% | 6-Hydroxymethylpyridine-2-carboxaldehyde (0.137 g, 1.0 mmol) was dissolved in dry methanol (15 ml) with 4,4' methylene bis 2,6 diethyl aniline (0.155 g, 0.5 mmol). The pale yellow solution was left stirring at room temperature under nitrogen for 30 min. Then [Cu(MeCN)4][PF6] (0.018 g, 0.5 mmol) dissolved in dry methanol (5 ml) was added to the solution under a blanket of nitrogen. The solution, which quickly becomes red-brown in colour, was stirred at room temperature under nitrogen for 15 hours. The red-brown solid which precipitated was filtered off under vacuum and washed with diethyl ether (2 cm3). The product was dried under vacuum over P2O5 to constant weight. (0.27 g, 36%) Positive-ion FAB: m/z 1369 ([Cu2(L4)2(PF6)]+), 1224 ([Cu2(L4)2]+) 1H NMR (CD2Cl2, 400 MHz, 298K) : d 8.50 (1H, s, Him), 8.26 (1H, t, J=7.8 Hz, H4), 8.12 (1H, d, J=7.8 Hz, H3), 7.89 (1H, d, J=7.8 Hz, H5), 7.14 (1H, s, HPh), 6. 58 (1H, s, HPh), 4.35 (1H, dd, J=14.1, 4.1 Hz CH2OH), 3.95 (1H, br d, J=13.8 Hz CH2OH), 3.92 (1H, s, CH2spacer), 3.07 (1H, br s, OH) 2.59 (2H, m, CH2Me), 1.91 (2H, m, CH2Me), 1.03 (3H, t, J=7.4 Hz, Me), 0.64 (3H, t, J=7.3 Hz, Me) ppm. lmax/nm (MeCN) 466 (e/mol-1dm-3cm-1 3x104) MLCT nmax/cm-1 3500-3000w, 2962m, 1615m, 1583m, 1461m, 1428m, 1399m, 1339m, 1316m, 1194m, 1140m, 1083m, 1003m, 979m, 920m, 880m, 844s, 789m, 735m, 648M, 607m |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
69% | In dichloromethane; at 20℃; for 0.5h; | General procedure: [Cu(MeCN)4]PF6 (75 mg, 0.20mmol) was added to dppp (82 mg, 0.20mmol) in 5mL of dichloromethane. Then, bpy (32 mg, 0.20mmol) was added and the solution immediately changed to yellow. The reaction mixture was stirred for 30 min at room temperature. Diethyl ether was added to the solution to precipitate the product as a yellow solid, which was filtered and washed with diethyl ether: yield, 126 mg (0.162mmol, 81percent). |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
94% | at 20℃; for 1.5h; | [Cu-(MeCN)4]PF6 (74 mg, 0.20 mmol) was added to TolBINAP(135 mg, 0.20 mmol) in 2 mL CH2Cl2. Then, bpy (31 mg, 0.20mmol) was added. The yellow reaction mixture was stirred for90 minutes at room temperature. Diethyl ether (25 mL) wasadded to the solution to precipitate the product as a yellowsolid, which was filtered and dried in vacuum: yield, 195 mg(94%). 1H NMR (500 MHz, acetone-d6): delta 8.97 (d, 2H, J =5 Hz, bpy), 8.81 (d, 2H, J = 8 Hz, bpy), 8.35 (t, 2H, J =8 Hz, bpy), 7.84 (m, 4H), 7.73 (d, 2H, J = 8 Hz, Ph), 7.46(m, 4H, Ph), 7.32 (m, 4H, Ph), 7.21 (m, 2H, Ph), 7.117.05(m, 8H, Ph), 6.92 (d, 2H, J = 8 Hz, Ph), 6.45 (d, 4H, Ph), 2.25(s, 6H, CH3), 1.96 (s, 6H, CH3). Elemental Analysis. Calcdfor C58H48N2F6P3Cu.0.5CH2Cl2: C, 64.70; H, 4.54; N, 2.58.Found: C, 65.02; H, 4.64; N, 2.31. |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
65% | In dichloromethane; at 20℃; for 1.5h; | General procedure: [Cu-(MeCN)4]PF6 (74 mg, 0.20 mmol) was added to TolBINAP(135 mg, 0.20 mmol) in 2 mL CH2Cl2. Then, bpy (31 mg, 0.20mmol) was added. The yellow reaction mixture was stirred for90 minutes at room temperature. Diethyl ether (25 mL) wasadded to the solution to precipitate the product as a yellowsolid, which was filtered and dried in vacuum. |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
In dichloromethane; at 20℃; for 0.5h;Inert atmosphere; | 1 (0.98mmol, 315mg) and 1,2-diacetonitrilebenzene (1.13mmol, 176mg) were dissolved in acetonitrile (25mL) and heated to reflux. DBU (1,8-Diazabicyclo [5.4.0] undec-7-ene, 1mmol, 156mg) was then added to the solution which turned dark green at once. After 4h of reflux, the medium was let to return to room temperature and water was added. The mixture was extracted twice with dichloromethane. The organic phase was then dried on sodium sulphate, filtered and evaporated to dryness. The crude was chromatographied on silica gel (eluent: dichloromethane/triethylamine 98/2 (v/v)). The first fraction contained the desired compound and 1,2-diacetonitrilebenzene (respectively 43% and 57% molar, estimated by NMR). The latter mixture was dissolved in dichloromethane, degassed by argon bubbling, and a degassed solution of Cu(CH3CN)4PF6 (0.21mmol, 77mg) was syringed herein. After 30min, the deep red solution is evaporated to dryness and subjected to chromatography column on silica gel (eluent: gradient from pure dichloromethane to a mixture of dichloromethane and methanol (98/2 v/v)). The collected orange fraction was then dissolved in acetonitrile (5mL) and a saturated aqueous solution of KCN (5mL) was added. The solution changes from dark red to light yellow within a few seconds. The latter was extracted twice with dichloromethane, dried on sodium sulphate, filtered and evaporated to dryness. The resulting yellow powder was the desired compound. Yield: 189mg (44% on the overall process). 1H NMR (300MHz, CDCl3, 25C): delta=9.69 (2H, d, J=8.7Hz), 8.63 (2H, dd, J=3.3Hz, J=6.6Hz), 7.92, (2H, dd, J=3.3Hz, J=6.6Hz), 7.60 (2H, d, J=8.7Hz), 3.21 (4H, m), 1.94 (4H, m), 1.53 (4H, m), 1.03 (6H, t, 7.5Hz) ppm. |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
100%Spectr. | In dichloromethane-d2; at 24.84℃; | In an NMR tube, compound 8 (1.33 mg, 2.21 mumol), <strong>[5093-70-9]4-bromo-2,6-dimethylpyridine</strong> (9, 412 mug,2.21 mumol), and [Cu(CH3CN)4]PF6 (825 mug, 2.21 mumol) were mixed in 500 muL of CD2Cl2 at roomtemperature. Yield: Quantitative |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
In dichloromethane-d2; at 24.84℃; | Guest and metal-dependent two-fold completive self-sorting was tested by mixing ligand 8 (1.33 mg,2.21 mumol), <strong>[5093-70-9]4-bromo-2,6-dimethylpyridine</strong> (9, 412 mug, 2.21 mumol), ZnTPP (10, 3.00 mg, 4.41 mumol),DABCO (4, 248 mug, 2.21 mumol) and [Cu(CH3CN)4]PF6 (825 mug, 2.21 mumol) in a ratio of 1:1:2:1:1 in500 muL of CD2Cl2 at room temperature. The 1H NMR spectrum was compared with those of the individual ligands and complexes. Accordingly, 11 = [Cu(8)(9)]+ and 12 = [DABCO(10)2] wereformed quantitatively |