| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 14 | Yes |
Popular Name: 1-Acetamidoadamantane 1-Acetamidoadamantane
Find On: PubMed — Wikipedia — Google
CAS Numbers: 880-52-4 , [13072-69-0] , [880-52-4]
| 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) | 2.38 | 4.81 | -6.98 | 1 | 2 | 0 | 29 | 193.29 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 2.63 | -31.56 | 2 | 2 | 1 | 34 | 194.298 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 146 - 148 | MolMall (formerly Molecular Diversity Preservation International) |
| Melting_Point | 146-149? | Alfa-Aesar |
| Melting_Point | 146-149° | Alfa-Aesar |
| MP | 148 | TCI |
| Mp [°C] | 148 - 150 | Acros Organics |
| Purity | 95% | Fluorochem |
| Purity | 99.0% | APIChem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H335: May cause respiratory irritation; H319: Causes serious eye irritation | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
