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Bis(8-Quinolinolato)Copper
CAS: 10380-28-6 | C18H12CuN2O2
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
10380-28-6
Molecular Formula:
C18H12CuN2O2
Molecular Weight:
351.8520000000001 g/mol
Names and Synonyms:
Bis(8-Quinolinolato)Copper
Common Name
Copper Clear
Synonym
PEI 273
Synonym
Penetraat
Synonym
PQ 357
Synonym
PQ 8
Synonym
Timtex
Synonym
Cuprinol Dispersion AQ
Synonym
Bis(8-hydroxyquinolinato)copper
Synonym
Cuproquin
Synonym
Copper-oxine
Synonym
Cupric 8-hydroxyquinolate
Synonym
Copper hydroxyquinolinate
Synonym
Copper 8-quinolinol
Synonym
Copper 8-hydroxyquinoline
Synonym
Copper oxinate
Synonym
Oxine-copper
Synonym
Copper 8-hydroxyquinolinate
Synonym
Copper(II) bis(8-quinolinolate)
Synonym
CUPRIC 8-OXYQUINOLINE
Synonym
Copper(II) oxinate
Synonym
Betaxate
Synonym
Arbrex 805
Synonym
Quin 20
Synonym
Nylate 10
Synonym
Timtex 17
Synonym
Fennotox 45
Synonym
Copper bis(8-hydroxyquinolinate)
Synonym
Copper hydroxyquinolate
Synonym
Copper(2+) oxinate
Synonym
Copper quinolinolate
Synonym
8-Hydroxyquinoline copper salt
Synonym
Cupric 8-quinolinolate
Synonym
Quinolate 20
Synonym
Copper, bis(8-quinolinolato)-
Synonym
Quinolate
Synonym
Copper oxyquinoline
Synonym
Bis(8-quinolinolato-κN1,κO8)copper
Synonym
PQ 8 (fungicide)
Synonym
Bioquin
Synonym
Oxidong
Synonym
Cunilate 2174
Synonym
Bis(8-oxyquinoline)copper
Synonym
Copper 8-hydroxyquinolate
Synonym
Oxyquinoline copper
Synonym
Bis(8-quinolinolato)copper(II)
Synonym
NSC 7720
Synonym
Cu 8
Synonym
PQ 57
Synonym
Yukilate CD 50
Synonym
Cu 8Q
Synonym
Cunilate 2419-75
Synonym
Timtex AQS
Synonym
Cunilate 2419
Synonym
Copper dioxinate
Synonym
Copper 8-quinolinolate (1:2)
Synonym
Copper 8-quinolate
Synonym
Bis(8-quinolinolato)copper
Synonym
Milmer 1
Synonym
Copper oxyquinolate
Synonym
Copper quinolate
Synonym
Quinolate 15
Synonym
8-Hydroxyquinoline copper(2+) salt
Synonym
Copper 8-quinolinolate
Synonym
Copper, bis(8-quinolinolato-N1,O8)-
Synonym
Copper, bis(8-quinolinolato-κN1,κO8)-
Synonym
Identifiers:
SMILES:
[Cu+2].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChI:
InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 351.8520000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 351.01947512400005 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 23 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 4 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 4 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 71.9 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 2.6143 | RDKit |
| cas-name | Bis(8-quinolinolato)copper None | Legacy Database |
| molecular_mass | 351.85 g/mol | Legacy Database |
| density | 1.63 g/cm³ | Legacy Database |
| cas-canonical-smile | [O-]1C2=CC=CC=3C=CC=[N](C23)[Cu+2]14[O-]C5=CC=CC=6C=CC=[N]4C56 None | Legacy Database |
| cas-density | 1.63 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2 None | Legacy Database |
| cas-inchi-key | InChIKey=YXLXNENXOJSQEI-UHFFFAOYSA-L None | Legacy Database |
| cas-melting-point | >270 °C (decomp) None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 82.37800000000006 | RDKit |