| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 17 | Yes |
Popular Name: 2-(Trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid 2-(Trifluoromethyl)-1,8-naphthyr…
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CAS Numbers: 241154-08-5 , [241154-08-5]
1,8-Naphthyridine-3-carboxylic acid, 2-(trifluoromethyl)- (9CI)
2- -1,8-NAPHTHYRIDINE-3-CARBOXYLICACID
2-(Trifluoromethyl)-1,8-naphthyridine-3-carboxylicacid
2-(Trifluoromethyl)-1,8-napthyridine-3-carboxylic
2-(Trifluoromethyl)-1,8-napthyridine-3-carboxylic acid
2-(Trifluoromethyl)-1,8-napthyridine-3-carboxylicacid
| 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) | 2.20 | 4.47 | -51.7 | 0 | 4 | -1 | 66 | 241.148 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.20 | 4.75 | -62.9 | 1 | 4 | 0 | 67 | 242.156 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 309-310° | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Warnings | Irritant | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.