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Molecule
Cobalt Octoate
CAS: 136-52-7 · C8H16CoO2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 136-52-7
- Molecular Formula
- C8H16CoO2
- Molecular Mass
- 203.15 g/mol
Identifiers
CAS Registry Number
136-52-7
SMILES
CCCCC(CC)C(=O)O.[Co]
InChI Key
AAZSASWTJCLJGM-UHFFFAOYSA-N
InChI
InChI=1S/C8H16O2.Co/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);
Names and Synonyms
- Cobalt Octoate Common Name
- Hexanoic acid, 2-ethyl-, cobalt(2+) salt (2:1) Synonym
- Hexanoic acid, 2-ethyl-, cobalt(2+) salt Synonym
- Cobalt(II) 2-ethylhexanoate Synonym
- Cobalt bis(2-ethylhexanoate) Synonym
- Versneller NL 49 Synonym
- Cobalt octoate Synonym
- Cobaltous octoate Synonym
- CO 12 Synonym
- Cobaltous 2-ethylhexanoate Synonym
- NL 49P Synonym
- NL 51P Synonym
- NL 51S Synonym
- 2-Ethylhexanoic acid cobalt(2+) salt Synonym
- Cobalt 2-ethylhexanoate (1:2) Synonym
- 8SEH-Co Synonym
- C 101 (catalyst) Synonym
- NL 49S Synonym
- C 101 Synonym
- Co 10 Synonym
- Co 10 (catalyst) Synonym
- Octlife Co 12 Synonym
- Octlife Co 8 Synonym
- NZ 495 Synonym
- Accelerator G Synonym
- Cobalt(II) octoate Synonym
- Norpol Accelerator 9802P Synonym
- Bis(2-ethylhexanoate)cobalt Synonym
- NUSA Co Synonym
- Commet Synonym
- Accelerator NL 51P Synonym
- Unidry CO 12 Synonym
- Dicnate 208V Synonym
- AR-NL 49P Synonym
- OK 2 Synonym
- OK 2 (metal salt) Synonym
- Accelerator NL 53 Synonym
- Valirex Co 10D60 Synonym
- F 12 Synonym
- Pergaquick C 12X Synonym
- Accelerator 553S Synonym
- Norpol 9802 Synonym
- Nuodex Co 10NEO Synonym
- Octope AE Synonym
- NA 980-2P Synonym
- 2-Ethylhexanoic acid cobalt(II) salt Synonym
- Valirex Co 12D60 Synonym
- Crystic Accelerator G Synonym
- F 533B Synonym
- Cobalt Hex-Cem Synonym
- RP 330 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 203.15 g/mol | CAS Common Chemistry |
| 203.147 g/mol | RDKit | |
| 205.163 g/mol | chempirical lib | |
| Density | 1.01 g/cm³ | CAS Common Chemistry |
| 1.013 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Canonical SMILES | [Co].O=C(O)C(CC)CCCC | CAS Common Chemistry |
| InChI | InChI=1S/C8H16O2.Co/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10); | CAS Common Chemistry |
| InChI Key | InChIKey=AAZSASWTJCLJGM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cobalt octoate | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 2.2849 | RDKit |
| Molar Refractivity | 40.9418 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.875 | RDKit |
| 0.88 | chempirical lib | |
| Exact Mass | 203.048224752 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 203.15 g/mol; density = 1.010 g/mL. Edit any field — others recompute live.
