| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2008 | 10 | No |
Popular Name: 3-AMINO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE 3-AMINO-5,5-DIMETHYL-2-CYCLOHEXE…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 33419-22-6 , 873-95-0
2-Cyclohexenone, 3-amino-5,5-dimethyl-
3-Amino-5,5-dimethyl-2-cyclohexene-1-one
3-amino-5,5-dimethylcyclohex-2-en-1-one
3-Amino-5,5-dimethylcyclohex-2-enone
3-Amino-5,5-dimethylcyclohex-2-enone hydrochloride
| 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) | 1.08 | 2.63 | -14.1 | 2 | 2 | 0 | 43 | 139.198 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 2.72 | -40.11 | 1 | 2 | -1 | 47 | 138.19 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 166 | TCI |
| MP | 167 - 170 | Enamine Building Blocks |
| MP | 167...170 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
