| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 14 | No |
Popular Name: 3,4-Methylenedioxy-beta-nitrostyrene 3,4-Methylenedioxy-beta-nitrosty…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1485-00-3 , 22568-48-5
1-(3,4-Methylenedioxy)phenyl-2-nitroethene
3,4-Methylenedioxy-beta-nitrostyrene, 98%
5-(2-nitroethenyl)-2H-1,3-benzodioxole
5-(2-nitrovinyl)-1,3-benzodioxole
5-(2-Nitrovinyl)benzo[d][1,3]dioxole
| 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) | 2.00 | 5.27 | -8.8 | 0 | 5 | 0 | 64 | 193.158 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 159-163? | Alfa-Aesar |
| Melting_Point | 159-163° | Alfa-Aesar |
| MP | 54 - 56 | Enamine Building Blocks |
| MP | 54...56 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Target | Others | Selleck Chemicals |
| Target | Tyrosinase,p97,Syk,Src | Selleck Chemicals |
