| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2009 | 11 | Yes |
Popular Name: 6-Chloro-1,2,3,4-tetrahydroisoquinoline 6-Chloro-1,2,3,4-tetrahydroisoqu…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 33537-97-2 , 33537-99-4 , 62882-02-4 , 766545-20-4 , [33537-99-4]
6-Chloro-1,2,3,4-tetrahydro-isoquinoline HCl
6-Chloro-1,2,3,4-tetrahydro-isoquinoline hydrochloride
6-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride
6-Chloro-1,2,3,4-tetrahydroisoquinoline, 95%
| 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) | 2.14 | 3.63 | -2.45 | 1 | 1 | 0 | 12 | 167.639 | 0 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 5.07 | -46.56 | 2 | 1 | 1 | 17 | 168.647 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | US5773437 | IBM Patent Data |
