| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 18 | Yes |
Popular Name: 3-(3,5-Dimethyl-isoxazol-4-ylmethoxy)-benzoic acid 3-(3,5-Dimethyl-isoxazol-4-ylmet…
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CAS Number: 315692-86-5
3-(3,5-dimethyl-isoxazol-4-ylmethoxy)-benzoicacid
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoic acid
3-[(3,5-dimethylisoxazol-4-yl)methoxy]benzoic acid
| 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) | 2.33 | 2.05 | -55.64 | 0 | 5 | -1 | 75 | 246.242 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 157 - 159 | Enamine Building Blocks |
| MP | 157...159 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
