| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 11 | Yes |
Popular Name: 3-Iodo-4-methylbenzoic acid 3-Iodo-4-methylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 20039-68-3 , 82998-57-0 , [82998-57-0]
"3-Iodo-4-methylbenzoic acid, 97%"
3-Iodo-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) | 3.31 | 0.3 | -48.16 | 0 | 2 | -1 | 40 | 261.038 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 200 - 202 | Enamine Building Blocks |
| MP | 200...202 | Enamine Building Blocks |
| MP | 201-212° | Oakwood Chemical |
| Melting_Point | 206-210? | Alfa-Aesar |
| Melting_Point | 206-210° | Alfa-Aesar |
| MP | 209 | TCI |
| MP | 210 - 212 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 97.5% | APIChem |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
