| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2014 | 0 | No |
Popular Name: 2-methylcyclopent-2-en-1-one 2-methylcyclopent-2-en-1-one
Find On: PubMed — Wikipedia — Google
CAS Number: 1120-73-6
| 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) | 0.95 | 3.84 | -7.09 | 0 | 1 | 0 | 17 | 96.129 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 104 - 106 | Enamine Building Blocks |
| MP | 104...106 | Enamine Building Blocks |
| BP [°C] | 158 - 161 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| H phrase | H226: Flammable liquid and vapor | Acros Organics |
| P phrase | P210: Keep away from heat/sparks/open flames/hot surfaces. - No smoking | Acros Organics |
| R phrase | R10: Flammable. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.