In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 15 | Yes |
Popular Name: [6-(difluoromethoxy)-2H-1,3-benzodioxol-5-yl]methanamine [6-(difluoromethoxy)-2H-1,3-benz…
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CAS Number: 1250675-73-0
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) | 1.55 | 0.82 | -51.52 | 3 | 4 | 1 | 55 | 218.179 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 0.41 | -7.95 | 2 | 4 | 0 | 54 | 217.171 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 39 - 41 | Enamine Building Blocks |
MP | 39...41 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |