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Molecule
Zinc Octanoate
CAS: 557-09-5 · C8H16O2Zn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 557-09-5
- Molecular Formula
- C8H16O2Zn
- Molecular Mass
- 209.60 g/mol
Identifiers
CAS Registry Number
557-09-5
SMILES
CCCCCCCC(=O)O.[Zn]
InChI Key
SVKHPROIBKURCL-UHFFFAOYSA-N
InChI
InChI=1S/C8H16O2.Zn/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);
Names and Synonyms
- Zinc Octanoate Synonym
- Octanoic acid, zinc salt (2:1) Synonym
- Octanoic acid, zinc salt Synonym
- Zinc octanoate Synonym
- Zinc caprylate Synonym
- Zinc octoate Synonym
- Zinc octylate Synonym
- Zinc dioctylate Synonym
- Zinc (II) octoate Synonym
- Siccatol ZN 12 Synonym
- O/S Zink 10 Aqua Synonym
- Baerostab L 230 Synonym
- Stabilol VZN 1950 Synonym
- Z 08 Synonym
- LBZ 732 Synonym
- Octoate Z Synonym
- Zn Octoate Synonym
- Zinc(II) bis(n-octoate) Synonym
- PP 23 Synonym
- Caprylic acid zinc salt Synonym
- Octlife ZnS Synonym
- Z 08 (stabilizer) Synonym
- Plastistab 2275 Synonym
- Z 08N Synonym
- K-KAT XK 661 Synonym
- Valirex Zn 8.0 Synonym
- Valirex Zn 8 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 209.60 g/mol | CAS Common Chemistry |
| 209.60399999999998 g/mol | RDKit | |
| 209.604 g/mol | RDKit | |
| 211.61 g/mol | chempirical lib | |
| Density | 1.19 g/cm³ | CAS Common Chemistry |
| 1.19 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Zn].O=C(O)CCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C8H16O2.Zn/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10); | CAS Common Chemistry |
| InChI Key | InChIKey=SVKHPROIBKURCL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 136 °C | CAS Common Chemistry |
| Name | Zinc octanoate | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 2.4290000000000003 | RDKit |
| 2.429 | RDKit | |
| Molar Refractivity | 41.0118 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.875 | RDKit |
| 0.88 | chempirical lib | |
| Exact Mass | 208.044171952 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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.
External Resources
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Quick conversion
MW = 209.60 g/mol; density = 1.190 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H16O2Zn.
