In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 13 | No |
Popular Name: Methyl 4-(bromomethyl)-3-fluorobenzoate Methyl 4-(bromomethyl)-3-fluorob…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 128577-47-9 , [128577-47-9]
4-BROMOMETHYL-3-FLUOROBENZOIC ACID METHYL ESTER
4-BROMOMETHYL-3-FLUOROBENZOICACIDMETHYLESTER
Benzoicacid, 4-(bromomethyl)-3-fluoro-, methyl ester
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) | 2.91 | 6.57 | -6.96 | 0 | 2 | 0 | 26 | 247.063 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.