In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 11 | No |
Popular Name: 1-(2-Bromo-ethoxy)-3-methyl-benzene 1-(2-Bromo-ethoxy)-3-methyl-benzene
Find On: PubMed — Wikipedia — Google
CAS Numbers: 6512-13-6 , [6512-13-6]
1-(2-Bromoethoxy)-3-methylbenzene
3-(2-Bromoethoxy)Benzotrifluoride; (2-Bromo-3'-(trifluoromethyl)Phenteole)
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) | 3.16 | 0.63 | -4.6 | 0 | 1 | 0 | 9 | 215.09 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |
PUBCHEM_PATENT_ID | US4207343 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.