| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 14 | Yes |
Popular Name: 6-bromo-3-chloro-1-benzothiophene-2-carboxylic acid 6-bromo-3-chloro-1-benzothiophen…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 438613-29-7 , [438613-29-7]
6-Bromo-3-chloro-1-benzothiophene-2-carboxylicacid
6-Bromo-3-chloro-benzo[b]thiophene-2-carboxylic
6-Bromo-3-chloro-benzo[b]thiophene-2-carboxylic acid
6-Bromo-3-chloro-benzo[b]thiophene-2-carboxylicacid
6-Bromo-3-chlorobenzo[b]thiophene-2-carboxylic acid
| 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) | 4.11 | -1.19 | -45.05 | 0 | 2 | -1 | 40 | 290.545 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 286 - 288 | Enamine Building Blocks |
| MP | 286...288 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.