| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2007 | 13 | Yes |
Popular Name: 6-bromobenzo[b]thiophene-2-carboxylic acid 6-bromobenzo[b]thiophene-2-carbo…
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CAS Numbers: 19075-58-2 , [19075-58-2]
6-bromo-1-benzothiophene-2-carboxylic acid
6-Bromo-1-Benzothiophene-2-CarboxylicAcid
6-BROMO-BENZO[B]THIOPHENE-2-CARBOXYLICACID
Benzo[b]thiophene-2-carboxylic acid, 6-bromo-
| 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) | 3.50 | -1.02 | -46.57 | 0 | 2 | -1 | 40 | 256.1 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 262 - 265 | KeyOrganics |
| MP | 262-265° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.