| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2008 | 15 | Yes |
Popular Name: methyl 3-amino-6-bromo-1-benzothiophene-2-carboxylate methyl 3-amino-6-bromo-1-benzoth…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 1017782-63-6 , N/A
benzo[b]thiophene-2-carboxylic acid, 3-amino-6-bromo-, methyl ester
Methyl 3-amino-6-bromobenzo[b]thiophene-2-carboxylate
methyl-3-amino-6-bromobenzo[b]thiophene-2-carboxylate
methyl3-amino-6-bromo-1-benzothiophene-2-carboxylate
| 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) | 3.17 | -1.23 | -6.49 | 2 | 3 | 0 | 52 | 286.15 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 126 - 128 | KeyOrganics |
| MP | 126-128° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
