| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 18 | Yes |
Popular Name: Tert-butyl 6-bromo-3,4-dihydroisoquinoline-2(1H)-carboxylate Tert-butyl 6-bromo-3,4-dihydrois…
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CAS Number: 893566-74-0
2(1H)-Isoquinolinecarboxylic acid, 6-bromo-3,4-dihydro-, 1,1-dimethylethyl ester
6-bromo-1,2,3,4-tetrahydroisoquinoline hydrochloride
tert-butyl-6-bromo-3,4-dihydroisoquinoline-2(1H)-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) | 3.55 | 8.28 | -5.94 | 0 | 3 | 0 | 30 | 312.207 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.