| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 17 | Yes |
Popular Name: 5-Oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxylic acid 5-Oxo-2,3-dihydro-1H,5H-pyrido[3…
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CAS Number: 386715-42-0
(2-Isopropoxyphenyl)methanamine hydrochloride
2,3-Dihydro-5-oxo-(1H,5H)-benzo[ij]-quinolizine-6-carboxylic acid
2,3-Dihydro-5-oxo-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxylic acid
5-Oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-
| 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) | 1.69 | 7.01 | -68.79 | 0 | 4 | -1 | 62 | 228.227 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 255 - 258° | Fluorochem |
| MP | 255-258° | Matrix Scientific |
| Purity | 95%+ | Fluorochem |
| Warnings | Irritant | Matrix Scientific |
