Chemical Name - 4-Acetyl Biphenyl
Mol Weight - 196.248
Smiles - CC(c(cc1)ccc1-c1ccccc1)=O
Mol Weight - 196.248
Smiles - CC(c(cc1)ccc1-c1ccccc1)=O
| Property Value | |
| Mol Name | 4-Acetyl Biphenyl |
| Molweight | 196.248 |
| Monoisotopic Mass | 196.088815 |
| Clogp | 3.19 |
| Clogs | -4.386 |
| H Acceptors | 1 |
| Total Surface Area | 163.03 |
| Relative Psa | 0.079985 |
| Polar Surface Area | 17.07 |
| Druglikeness | -1.9442 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.66667 |
| Molecular Flexibility | 0.40333 |
| Molecular Complexity | 0.58727 |
| Fragments | 1 |
| Non H Atoms | 15 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bonds | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3 Atoms | 1 |
| Symmetric Atoms | 4 |
| Smiles | CC(c(cc1)ccc1-c1ccccc1)=O |
| InChIKey | InChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3 |
| InChI | QCZZSANNLWPGEA-UHFFFAOYSA-N |
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