| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2005 | 16 | No |
Popular Name: 3,4-Dimethoxy-beta-methyl-beta-nitrostyrene 3,4-Dimethoxy-beta-methyl-beta-n…
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CAS Number: 122-47-4
| 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) | 2.58 | 2.71 | -9.05 | 0 | 5 | 0 | 64 | 223.228 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 68-71° | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.