Chemical Name - Xylitol
Mol Weight - 152.145
Smiles - OC[C@H]([C@@H]([C@H](CO)O)O)O
Mol Weight - 152.145
Smiles - OC[C@H]([C@@H]([C@H](CO)O)O)O
| Property Value | |
| Mol Name | Xylitol |
| Molweight | 152.145 |
| Monoisotopic Mass | 152.068475 |
| Clogp | -2.5784 |
| Clogs | 0.417 |
| H Acceptors | 5 |
| H Donors | 5 |
| Total Surface Area | 110.27 |
| Relative Psa | 0.594 |
| Polar Surface Area | 101.15 |
| Druglikeness | -0.73911 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.7 |
| Molecular Flexibility | 0.75872 |
| Molecular Complexity | 0.65976 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Stereo Centers | 3 |
| Rotatable Bonds | 4 |
| Sp3 Atoms | 10 |
| Smiles | OC[C@H]([C@@H]([C@H](CO)O)O)O |
| InChIKey | InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5+ |
| InChI | HEBKCHPVOIAQTA-SCDXWVJYSA-N |
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