In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2010 | 12 | Yes |
Popular Name: 2-BROMO-3-FLUOROBENZOTRIFLUORIDE 2-BROMO-3-FLUOROBENZOTRIFLUORIDE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 104540-42-3 , [104540-42-3]
2-Bromo-1-fluoro-3-(trifluoromethyl)benzene
2-Bromo-3-fluorobenzotrifluoride 98%
2-Bromo-3-fluorobenzotrifluoride, 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) | 3.71 | 6.03 | -5.22 | 0 | 0 | 0 | 0 | 242.997 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 167-168° | Oakwood Chemical |
Purity | 98% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.