Chemical Name - Caprylic Acid
Mol Weight - 144.213
Smiles - CCCCCCCC(O)=O
Mol Weight - 144.213
Smiles - CCCCCCCC(O)=O
| Property Value | |
| Mol Name | Caprylic Acid |
| Molweight | 144.213 |
| Monoisotopic Mass | 144.11503 |
| Clogp | 2.4273 |
| Clogs | -2.079 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 132.42 |
| Relative Psa | 0.1974 |
| Polar Surface Area | 37.3 |
| Druglikeness | -25.323 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.9 |
| Molecular Flexibility | 0.57635 |
| Molecular Complexity | 0.48648 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 6 |
| Sp3 Atoms | 8 |
| Acidic Oxygens | 1 |
| Smiles | CCCCCCCC(O)=O |
| InChIKey | |
| InChI | C8H16O2 |
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1 - Caprylic Acid
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