| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 11 | Yes |
Popular Name: 3-Bromo-4-methylbenzoic acid 3-Bromo-4-methylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 7697-26-9 , [7697-26-9]
"3-Bromo-4-methylbenzoic acid, 97%"
3-Bromo-4-methylbenzoic acid, 98+%
| 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) | 3.03 | 0.37 | -47.97 | 0 | 2 | -1 | 40 | 214.038 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 200 - 202 | Enamine Building Blocks |
| MP | 200...202 | Enamine Building Blocks |
| MP | 206-208° | Matrix Scientific |
| Melting_Point | 206-211? | Alfa-Aesar |
| Melting_Point | 206-211° | Alfa-Aesar |
| MP | 210 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95.8% | APIChem |
| Purity | 97% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
