| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2005 | 12 | Yes |
Popular Name: Isoquinolin-1-ylmethanamine Isoquinolin-1-ylmethanamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1177303-46-6 , 19382-38-8 , 40615-08-5 , [40615-08-5]
1-isoquinolin-1-ylmethanamine dihydrochloride
1-isoquinolin-1-ylmethanamine hydrochloride
1-Isoquinolinemethanamine dihydrochloride
C-Isoquinolin-1-yl-methylamine
C-Isoquinolin-1-yl-methylamine 2HCl
| 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) | 1.47 | 2.81 | -45.41 | 3 | 2 | 1 | 41 | 159.212 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.47 | 3.07 | -111.01 | 4 | 2 | 2 | 42 | 160.22 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 185 - 187 | Enamine Building Blocks |
| MP | 185...187 | Enamine Building Blocks |
| MP | 319 - 321 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
