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Cas Database |
| Name |
Zinc phthalocyanine |
EINECS | 238-262-5 |
| CAS No. | 14320-04-8 | Density | 1.614-1.62g/cm3 at 20℃ |
| PSA | 99.94000 | LogP | 1.14850 |
| Solubility | Insoluble in water. | Melting Point |
N/A |
| Formula | C32H16N8Zn | Boiling Point | N/A |
| Molecular Weight | 577.923 | Flash Point | N/A |
| Transport Information | N/A | Appearance | purple powder |
| Safety | 22-24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Zinc, [29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (SP-4-1)-;Zinc, [phthalocyaninato(2-)]- (8CI);29H,31H-Phthalocyanine, zinc complex;29H,31H-Phthalocyanine, zinc deriv.;CGP 55847;Ciaftalan zinc;Phthalocyaninatozinc;Zinc phthalocyanine complex;Zinc(2+) phthalocyaninate;Zinc(II) phthalocyanine;Phthalocyanine,zinc deriv. (6CI); |
Article Data | 57 |
Zinc phthalocyanine Synthetic route
| Conditions | Yield |
|---|---|
| With sodium methylate In methanol Sonication; Zn added to a methanol soln. containing an equivalent quantity of phthalonitrile and 5 drops of 30% soln of CH3ONa in methanol; flask put into an ultrasonic cleaner and maintained at 50°C for 24-72 h; blue product separated from unreacted metal by shaking and decanting with the solvent, washed with ethanol in Soxhlet equipment and dried in air; purity of 95-97%; elem. anal.; | 100% |
| With sodium methylate In further solvent(s) Sonication; Zn added to an 1-octanol soln. containing an equivalent quantity of phthalonitrile and 5 drops of 30% soln of CH3ONa in methanol; flask put intoan ultrasonic cleaner and maintained at 50°C for 24-72 h; blue product separated from unreacted metal by shaking and decanting with the solvent, washed with ethanol in Soxhlet equipment and dried in air; purity of 95-97%; elem. anal.; | 100% |
| With sodium methylate In methanol Sonication; Zn added to a methanol soln. containing an equivalent quantity of phthalonitrile and 5 drops of 30% soln of CH3ONa in methanol; flask put into an ultrasonic cleaner and maintained at 40°C for 24-72 h; blue product separated from unreacted metal by shaking and decanting with the solvent, washed with ethanol in Soxhlet equipment and dried in air; purity of 95-97%; elem. anal.; | 85% |
| Conditions | Yield |
|---|---|
| In N,N-dimethyl-formamide at 200℃; for 0.166667h; Microwaves; | 95% |
| In N,N-dimethyl-formamide other Radiation; to mixt. Zn(OAc)2*2H2O and phthalonitrile DMF was added and heated in microwave Discover CEM reactor to 200°C for 10 min in sealed tube; Soxhlet extraction with acetone, CH2Cl2, and MeCN followed by recrystn. from pyridine; | 95% |
| In N,N-dimethyl-formamide at 110℃; under 7500.75 Torr; for 0.00694444h; Pressure; Microwave irradiation; | 92% |
| With butyl(2-hydroxyethyl)dimethylammonium acetate at 100℃; for 2h; Ionic liquid; Inert atmosphere; | 86% |
| Conditions | Yield |
|---|---|
| With butyl(2-hydroxyethyl)dimethylammonium acetate at 100℃; Ionic liquid; Inert atmosphere; | 92% |
| With tributyl-amine In pentan-1-ol at 160℃; for 2h; Inert atmosphere; | 26 mg |
- 91-15-6
phthalonitrile
- 14320-04-8
zinc(II) phthalocyanine
| Conditions | Yield |
|---|---|
| With zinc diacetate In nitrobenzene for 5h; Reflux; | 83% |
| Conditions | Yield |
|---|---|
| With sodium methylate In tetrahydrofuran 3 equiv. NaOMe, 20 °C, stirring for 7 days, addn. of metal salt,stirring for 3 days; | 82% |
| With 1,8-diazabicyclo[5.4.0]undec-7-ene In pentan-1-ol under N2, 1,8-diazabicyclo(5.4.0)undec-7-ene (5 mmol) added to C6H4(CN)2(5 mmol) and Zn(CH3COO)2 (1.25 mmol) soln., heated for 36 h under reflu x; D. Woehrle, G. Schnurpfel, G. Knothe, Dyes Pigm. 18, 91 (1992); MeOH added, washed (with H2O and MeOH), treated with MeOH in Soxhlet apparatus overnight, dried.; purified by sublimation in vac. at 370°C; | 75% |
| With 1,8-diazabicyclo[5.4.0]undec-7-ene In pentan-1-ol for 12h; Inert atmosphere; Reflux; | 48% |
| With 1,8-diazabicyclo[5,4,0]undec-7-ene In pentan-1-ol reflux; filtration, washing (water), extraxting with MeOH in a Soxhilet apparatus, zone sublimation at 1E-7 - 1E-6 mbar at 370 °C; | |
| In ethanol at 160℃; for 6h; Solvent; Autoclave; High pressure; Green chemistry; |
| Conditions | Yield |
|---|---|
| With 1,8-diazabicyclo{5.4.0}undec-7-ene In pentan-1-ol a mixt. of the Cu salt, phthalonitrile, and the base (molar ratio 2.5:10:10) was refluxed in n-pentanol for 6 h;; the ppt. was filtered off, washed with 3% HCl soln., water, and ethanol and purified by extrn. with CHCl3; IR, UV, XRD, and elem.anal.;; | 74% |
| With hydroquinone Thompson, J. A.; Murata, K.; Miller, D. C.; Stanton, J. L.; Broderick, W. E.; Hoffmann, B. M.; Ibers, J. A. Inorg. Chem. 1993, 32, 3546;; Soxhlet extn. with water and then acetone for 24 h each; | |
| With ammonia; hexaammonium heptamolybdate tetrahydrate In nitrobenzene mixt. of o-phthalodinitrile, ZnCl2, nitrobenzene, ammonium molybdate, and ammonia stirred (6 h); refluxed; stripped with ammonia; filtered; washed with methanol; pptd. from 96 % H2SO4; | |
| With 1,8-diazabicyclo[5.4.0]undec-7-ene In pentan-1-ol at 140℃; for 2h; Inert atmosphere; | 263 mg |
| With ammonium hydroxide In dimethyl sulfoxide at 180 - 190℃; for 5h; |
| Conditions | Yield |
|---|---|
| With 1,8-diazabicyclo{5.4.0}undec-7-ene In pentan-1-ol a mixt. of the Cu salt, phthalonitrile, and the base (molar ratio 2.5:10:10) was refluxed in n-pentanol for 6 h;; the ppt. was filtered off, washed with 3% HCl soln., water, and ethanol and purified by extrn. with CHCl3; IR, UV, XRD, and elem.anal.;; | 58% |
- 63368-36-5
ortho-methylbenzyltriphenylphosphonium chloride
- 91-15-6
phthalonitrile
- 7440-66-6
zinc
- 14320-04-8
zinc(II) phthalocyanine
- 1586046-62-9
27-(2-methylphenyl)tetrabenzo[b,g,l,q][5,10,15]triazaporphyrinato zinc
| Conditions | Yield |
|---|---|
| at 200 - 300℃; for 6h; Inert atmosphere; | A 25% B 11% |
- 887928-88-3
5,6-dicyano-2-(4-(triisopropylsilylethynyl)phenyl)-1-propylbenzimidazole
- 91-15-6
phthalonitrile
- 7646-85-7
zinc(II) chloride
- 14320-04-8
zinc(II) phthalocyanine
- 887928-95-2
tribenzo[g,l,q]-(2-{4-(2-triisopropylsilylethynyl)phenyl}-1-propylbenzimidazo[5,6-b])porphyrazinatozinc(II)
- 887928-99-6
dibenzo[g,q]-(2-{4-(2-triisopropylsilylethynyl)phenyl}-1-propylbenzimidazo[5,6-b:5',6'-l])porphyrazinatozinc(II)-C2v
| Conditions | Yield |
|---|---|
| With 1,8-diazabicyclo[5.4.0]undec-7-ene In pentan-1-ol for 12h; Inert atmosphere; Reflux; | A 4% B 22% C 1% |
| Conditions | Yield |
|---|---|
| In N,N-dimethyl-formamide; 1,2-dichloro-benzene at 150 - 160℃; Inert atmosphere; | A n/a B 21% C n/a |
Zinc phthalocyanine Specification
The Zinc phthalocyanine with cas registry number of 14320-04-8, belongs to the following product categories: (1)Organometallics; (2)Classes of Metal Compounds; (3)Functional Materials; (4)Phthalocyanines; (5)Phthalonitriles & Naphthalonitriles; (6)Transition Metal Compounds; (7)Zn (Zinc) Compounds. And its systematic name is (29H,31H-Phthalocyaninato(2-)-N29,N30,N31,N32)zinc. Zinc Phthalocyanine is generally immediately available in most volumes.
Physical properties about Zinc phthalocyanine are: (1)#H bond acceptors: 8; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 0; (4)Polar Surface Area: 82.33 Å2 . Zinc phthalocyanine is purple powder.
When you are using this chemical, please be cautious about it as the following: Please do not breathe dust, and avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)InChI=1S/C32H16N8.Zn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2;
(2)InChIKey=PODBBOVVOGJETB-UHFFFAOYSA-N;
(3)Smilesn1c2nc(c3c2cccc3)nc2[n-]c(c3c2cccc3)nc2nc(c3c2cccc3)nc2[n-]c1c1c2cccc1.[Zn+2];
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