| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 14 | Yes |
Popular Name: Bornyl acetate Bornyl acetate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 125-12-2 , 20347-65-3 , 5655-61-8 , 76-49-3 , [125-12-2] , [5655-61-8]
(1S,2R,4S)-(-)-Bornyl acetate; 5655-61-8; C09837
| 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) | 3.05 | 3.3 | -4.81 | 0 | 2 | 0 | 26 | 196.29 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 106 / 4 | TCI |
| Boiling_Point | 220-224? | Alfa-Aesar |
| Boiling_Point | 220-224° | Alfa-Aesar |
| BP [°C] | 223 - 224 | Acros Organics |
| Boiling_Point | 223-224? | Alfa-Aesar |
| Boiling_Point | 223-224° | Alfa-Aesar |
| MP | 7 | TCI |
| Therapy | flavor, fragrance agent | SMDC Pharmakon |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
