Chemical Name - 3-Methoxypropanol
Mol Weight - 90.1214
Smiles - COCCCO
Mol Weight - 90.1214
Smiles - COCCCO
| Property Value | |
| Mol Name | 3-Methoxypropanol |
| Molweight | 90.1214 |
| Monoisotopic Mass | 90.06808 |
| Clogp | 0.0061 |
| Clogs | -0.368 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 83.39 |
| Relative Psa | 0.27701 |
| Polar Surface Area | 29.46 |
| Druglikeness | -4.1749 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 1 |
| Molecular Flexibility | 0.7146 |
| Molecular Complexity | 0.69315 |
| Fragments | 1 |
| Non H Atoms | 6 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 3 |
| Sp3 Atoms | 6 |
| Smiles | COCCCO |
| InChIKey | InChI=1S/C4H10O2/c1-6-4-2-3-5/h5H,2-4H2,1H3 |
| InChI | JDFDHBSESGTDAL-UHFFFAOYSA-N |
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1 - 3-Methoxypropanol
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