| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 1,3-ADAMANTANEDIOL 1,3-ADAMANTANEDIOL
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17071-62-4 , 5001-18-3 , 5984-56-5 , [5001-18-3]
| 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) | 1.48 | -0.04 | -4.09 | 2 | 2 | 0 | 40 | 168.236 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 257 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 258 | TCI |
| MP | 260° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
