| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 12 | Yes |
Popular Name: 4-Amino-2,2-difluoro-1,3-benzodioxole 4-Amino-2,2-difluoro-1,3-benzodi…
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CAS Numbers: 106876-54-4 , [106876-54-4]
2,2-Difluoro-1,3-benzodioxol-4-amine, 2,3-(Difluoromethylenedioxy)aniline
4-Amino-2,2-difluoro-1,3-benzodioxole 97+%
| 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) | 1.91 | 1.43 | -6.03 | 2 | 3 | 0 | 44 | 173.118 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| bp | 78 - 80 (p=6 torr) | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.