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Bis(8-Quinolinolato)Copper
CAS: 10380-28-6 | C18H12CuN2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
10380-28-6
Molecular Formula:
C18H12CuN2O2
Molecular Weight:
351.8520000000001 g/mol
Names and Synonyms:
Bis(8-Quinolinolato)Copper
Copper Clear
PEI 273
Penetraat
PQ 357
PQ 8
Timtex
Cuprinol Dispersion AQ
Bis(8-hydroxyquinolinato)copper
Cuproquin
Copper-oxine
Cupric 8-hydroxyquinolate
Copper hydroxyquinolinate
Copper 8-quinolinol
Copper 8-hydroxyquinoline
Copper oxinate
Oxine-copper
Copper 8-hydroxyquinolinate
Copper(II) bis(8-quinolinolate)
CUPRIC 8-OXYQUINOLINE
Copper(II) oxinate
Betaxate
Arbrex 805
Quin 20
Nylate 10
Timtex 17
Fennotox 45
Copper bis(8-hydroxyquinolinate)
Copper hydroxyquinolate
Copper(2+) oxinate
Copper quinolinolate
8-Hydroxyquinoline copper salt
Cupric 8-quinolinolate
Quinolate 20
Copper, bis(8-quinolinolato)-
Quinolate
Copper oxyquinoline
Bis(8-quinolinolato-κN1,κO8)copper
PQ 8 (fungicide)
Bioquin
Oxidong
Cunilate 2174
Bis(8-oxyquinoline)copper
Copper 8-hydroxyquinolate
Oxyquinoline copper
Bis(8-quinolinolato)copper(II)
NSC 7720
Cu 8
PQ 57
Yukilate CD 50
Cu 8Q
Cunilate 2419-75
Timtex AQS
Cunilate 2419
Copper dioxinate
Copper 8-quinolinolate (1:2)
Copper 8-quinolate
Bis(8-quinolinolato)copper
Milmer 1
Copper oxyquinolate
Copper quinolate
Quinolate 15
8-Hydroxyquinoline copper(2+) salt
Copper 8-quinolinolate
Copper, bis(8-quinolinolato-N1,O8)-
Copper, bis(8-quinolinolato-κN1,κO8)-
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
| Category | Property | Value | Source |
|---|---|---|---|
| Physical Properties | 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 | Legacy Database | |
| cas-density | 1.63 g/cm3 | 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 | Legacy Database | |
| cas-inchi-key | InChIKey=YXLXNENXOJSQEI-UHFFFAOYSA-L | Legacy Database | |
| cas-melting-point | >270 °C (decomp) | Legacy Database | |
| LogP | 2.6143 | RDKit | |
| cas-name | Bis(8-quinolinolato)copper | Legacy Database | |
| Molecular | Molecular Weight | 351.8520000000001 g/mol | RDKit |
| Exact | Exact Molecular Weight | 351.01947512400005 g/mol | RDKit |
| Heavy | Heavy Atom Count | 23 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 4 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit | |
| Rotatable | Rotatable Bonds | 0 count | RDKit |
| Aromatic | Aromatic Ring Count | 4 count | RDKit |
| Topological | Topological Polar Surface Area | 71.9 Ų | RDKit |
| Molar | Molar Refractivity | 82.37800000000006 | RDKit |
