Chemical Name - Nonyl Phenol
Mol Weight - 220.355
Smiles - CCCCCCCCCc(cccc1)c1O
Mol Weight - 220.355
Smiles - CCCCCCCCCc(cccc1)c1O
| Property Value | |
| Mol Name | Nonyl Phenol |
| Molweight | 220.355 |
| Monoisotopic Mass | 220.182715 |
| Clogp | 5.2542 |
| Clogs | -3.713 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 201.95 |
| Relative Psa | 0.064868 |
| Polar Surface Area | 20.23 |
| Druglikeness | -20.191 |
| Mutagenic | none |
| Tumorigenic | low |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.8125 |
| Molecular Flexibility | 0.50138 |
| Molecular Complexity | 0.53051 |
| Fragments | 1 |
| Non H Atoms | 16 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bonds | 8 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 10 |
| Smiles | CCCCCCCCCc(cccc1)c1O |
| InChIKey | InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3 |
| InChI | SNQQPOLDUKLAAF-UHFFFAOYSA-N |
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1 - Nonyl Phenol
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