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Cobalt Octoate
CAS: 136-52-7 | C8H16CoO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
136-52-7
Molecular Formula:
C8H16CoO2
Molecular Weight:
203.147 g/mol
Names and Synonyms:
Cobalt Octoate
RP 330
Cobalt Hex-Cem
F 533B
Crystic Accelerator G
Valirex Co 12D60
2-Ethylhexanoic acid cobalt(II) salt
NA 980-2P
Octope AE
Nuodex Co 10NEO
Norpol 9802
Accelerator 553S
Pergaquick C 12X
F 12
Valirex Co 10D60
Accelerator NL 53
OK 2 (metal salt)
OK 2
AR-NL 49P
Dicnate 208V
Unidry CO 12
Accelerator NL 51P
Commet
NUSA Co
Bis(2-ethylhexanoate)cobalt
Norpol Accelerator 9802P
Cobalt(II) octoate
Accelerator G
NZ 495
Octlife Co 8
Octlife Co 12
Co 10 (catalyst)
Co 10
C 101
NL 49S
C 101 (catalyst)
8SEH-Co
Cobalt 2-ethylhexanoate (1:2)
2-Ethylhexanoic acid cobalt(2+) salt
NL 51S
NL 51P
NL 49P
Cobaltous 2-ethylhexanoate
CO 12
Cobaltous octoate
Cobalt octoate
Versneller NL 49
Cobalt bis(2-ethylhexanoate)
Cobalt(II) 2-ethylhexanoate
Hexanoic acid, 2-ethyl-, cobalt(2+) salt
Hexanoic acid, 2-ethyl-, cobalt(2+) salt (2:1)
Identifiers:
SMILES:
CCCCC(CC)C(=O)O.[Co]
InChI:
InChI=1S/C8H16O2.Co/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 203.15 g/mol | Legacy Database |
| density | 1.01 g/cm³ | Legacy Database |
| cas-canonical-smile | [Co].O=C(O)C(CC)CCCC None | Legacy Database |
| cas-density | 1.013 g/cm3 @ Temp: 25 °C None | Legacy Database |
| cas-inchi | InChI=1S/C8H16O2.Co/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10); None | Legacy Database |
| cas-inchi-key | InChIKey=AAZSASWTJCLJGM-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Cobalt octoate None | Legacy Database |
| LogP | 2.2849 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 203.147 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 203.048224752 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 11 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 5 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 37.3 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 40.9418 | RDKit |
