| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2008 | 14 | Yes |
Popular Name: 4-oxo-1,4-dihydroquinoline-3-carboxylic acid 4-oxo-1,4-dihydroquinoline-3-car…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13721-01-2 , 34785-11-0 , [13721-01-2] , [3478-54-4] , [34785-11-0] , [508195-68-4]
1,4-Dihydro-4-oxo-quinoline-3-carboxylic acid
3-Quinolinecarboxylicacid, 4-hydroxy-
4-(5-Chloro-2-oxo-benzooxazol-3-yl)-butyric acid
4-hydroxy-3-quinolinecarboxylic acid
4-Hydroxy-quinoline-3-carboxylic acid
4-Hydroxyquinoline-3-carboxylic acid
4-Hydroxyquinoline-3-carboxylicacid
4-Oxo-1,4-dihydro-quinoline-3-carboxylic acid
| 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) | 0.21 | 5.8 | -68.88 | 1 | 4 | -1 | 73 | 188.162 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.21 | 4.98 | -29.28 | 2 | 4 | 0 | 76 | 189.17 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 4.55 | -129.86 | 0 | 4 | -2 | 76 | 187.154 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 3.95 | -39.88 | 2 | 4 | 0 | 74 | 189.17 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 250 - 252 | Enamine Building Blocks |
| MP | 250...252 | Enamine Building Blocks |
| MP | 251 - 253 | Enamine Building Blocks |
| MP | 269 - 271 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
