Chemical Name - Capric Acid
Mol Weight - 172.267
Smiles - CCCCCCCCCC(O)=O
Mol Weight - 172.267
Smiles - CCCCCCCCCC(O)=O
| Property Value | |
| Mol Name | Capric Acid |
| Molweight | 172.267 |
| Monoisotopic Mass | 172.14633 |
| Clogp | 3.3361 |
| Clogs | -2.619 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 159.94 |
| Relative Psa | 0.16344 |
| Polar Surface Area | 37.3 |
| Druglikeness | -25.216 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.91667 |
| Molecular Flexibility | 0.5527 |
| Molecular Complexity | 0.41589 |
| Fragments | 1 |
| Non H Atoms | 12 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 8 |
| Sp3 Atoms | 10 |
| Acidic Oxygens | 1 |
| Smiles | CCCCCCCCCC(O)=O |
| InChIKey | InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12) |
| InChI | GHVNFZFCNZKVNT-UHFFFAOYSA-N |
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1 - Capric Acid
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2 - Capric Acid
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