Chemical Name - 2,5 Dihydroxy 1,4 Dithiane
Mol Weight - 152.238
Smiles - OC1SCC(O)SC1
Mol Weight - 152.238
Smiles - OC1SCC(O)SC1
| Property Value | |
| Mol Name | 2,5 Dihydroxy 1,4 Dithiane |
| Molweight | 152.238 |
| Monoisotopic Mass | 151.99657 |
| Clogp | 1.112 |
| Clogs | -1.006 |
| H Acceptors | 2 |
| H Donors | 2 |
| Total Surface Area | 100.2 |
| Relative Psa | 0.61058 |
| Polar Surface Area | 91.06 |
| Druglikeness | 0.23778 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Flexibility | 0.32007 |
| Molecular Complexity | 0.62123 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Stereo Centers | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 8 |
| Symmetric Atoms | 4 |
| Smiles | OC1SCC(O)SC1 |
| InChIKey | InChI=1S/C4H8O2S2/c5-3-1-7-4(6)2-8-3/h3-6H,1-2H2 |
| InChI | YUIOPHXTILULQC-UHFFFAOYSA-N |
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1 - 2,5 Dihydroxy 1,4 Dithiane
2 - 2,5 Dihydroxy 1,4 Dithiane
1 - 2,5 Dihydroxy 1,4 Dithiane
2 - 2,5 Dihydroxy 1,4 Dithiane
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