| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 7 | No |
Popular Name: Bromocyclohexane Bromocyclohexane
Find On: PubMed — Wikipedia — Google
CAS Numbers: 108-85-0 , 108-86-1 , [108-85-0]
| 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) | 2.96 | 5.49 | -0.76 | 0 | 0 | 0 | 0 | 163.058 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 57? | Alfa-Aesar |
| Melting_Point | 57° | Alfa-Aesar |
| BP | 165 | TCI |
| BP [°C] | 166 - 167 | Acros Organics |
| Boiling_Point | 166-167? | Alfa-Aesar |
| Boiling_Point | 166-167° | Alfa-Aesar |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| R phrase | R18: In use, may form flammable/explosive vapour-air mixture. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.