Back to Search
Copper(Ii) Stearate
CAS: 660-60-6 | C18H36CuO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
660-60-6
Molecular Formula:
C18H36CuO2
Molecular Mass:
348.03 g/mol
Names and Synonyms:
Copper(Ii) Stearate
Octadecanoic acid, copper(2+) salt (2:1)
Stearic acid, copper(2+) salt
Octadecanoic acid, copper(2+) salt
Cupric stearate
Copper(II) stearate
Copper(2+) stearate
Copper distearate
Cupric distearate
Cupric octadecanoate
Copper(II) octadecanoate
Copper bis(octadecanoate)
Copper dioctadecanoate
Cu(octanoate)2
Identifiers:
SMILES:
CCCCCCCCCCCCCCCCCC(=O)O.[Cu]
InChI:
InChI=1S/C18H36O2.Cu/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);
Key Properties
Melting Point
250 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 348.03 g/mol | CAS Common Chemistry |
| 348.0299999999999 g/mol | RDKit | |
| 347.201127892 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Copper(II)_stearate | CAS Common Chemistry |
| Canonical SMILES | [Cu].O=C(O)CCCCCCCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C18H36O2.Cu/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20); | CAS Common Chemistry |
| InChI Key | InChIKey=YVENFKCVDQUMMA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 250 °C | CAS Common Chemistry |
| Name | Cupric stearate | CAS Common Chemistry |
| Copper(II) stearate | CAS Common Chemistry | |
| Heavy Atom Count | 21 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 16 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 6.330000000000006 | RDKit |
| Molar Refractivity | 87.18180000000008 | RDKit |
