In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2012 | 12 | Yes |
Popular Name: (6-bromo-3-methoxy-2-methylphenyl)methanol (6-bromo-3-methoxy-2-methylpheny…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 110451-91-7 , [110451-91-7]
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) | 2.45 | 2.27 | -5.4 | 1 | 2 | 0 | 29 | 231.089 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 87 - 90 | KeyOrganics |
MP | 87-90° | Matrix Scientific |
Purity | 97% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.