Chemical Name - n- Propanol
Mol Weight - 60.0955
Smiles - CCCO
Mol Weight - 60.0955
Smiles - CCCO
| Property Value | |
| Mol Name | n- Propanol |
| Molweight | 60.0955 |
| Monoisotopic Mass | 60.057515 |
| Clogp | 0.5049 |
| Clogs | -0.747 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 59.63 |
| Relative Psa | 0.21969 |
| Polar Surface Area | 20.23 |
| Druglikeness | -2.5387 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 1 |
| Molecular Flexibility | 0.66486 |
| Fragments | 1 |
| Non H Atoms | 4 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bonds | 1 |
| Sp3 Atoms | 4 |
| Smiles | CCCO |
| InChIKey | InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3 |
| InChI | BDERNNFJNOPAEC-UHFFFAOYSA-N |
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