| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 9 | No |
Popular Name: 2,5-Dimethylthiophenol 2,5-Dimethylthiophenol
Find On: PubMed — Wikipedia — Google
CAS Number: 4001-61-0
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.99 | 0.11 | -45.16 | 0 | 0 | -1 | 0 | 137.227 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 126-127?/50mm | Alfa-Aesar |
| Boiling_Point | 126-127°/50mm | Alfa-Aesar |
| BP | 126°/50mm | Fluorochem |
| Purity | 98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.