4-Amino-6-trifluoromethoxyquinoline - CAS 874880-25-8
Catalog: |
BB038498 |
Product Name: |
4-Amino-6-trifluoromethoxyquinoline |
CAS: |
874880-25-8 |
Synonyms: |
6-(trifluoromethoxy)quinolin-4-amine |
IUPAC Name: | 6-(trifluoromethoxy)quinolin-4-amine |
Description: | 4-Amino-6-trifluoromethoxyquinoline (CAS# 874880-25-8) is a useful research chemical. |
Molecular Weight: | 228.17 |
Molecular Formula: | C10H7F3N2O |
Canonical SMILES: | C1=CC2=NC=CC(=C2C=C1OC(F)(F)F)N |
InChI: | InChI=1S/C10H7F3N2O/c11-10(12,13)16-6-1-2-9-7(5-6)8(14)3-4-15-9/h1-5H,(H2,14,15) |
InChI Key: | KDFPUZKVCMQYIU-UHFFFAOYSA-N |
Boiling Point: | 319.1 °C at 760 mmHg |
Density: | 1.431 g/cm3 |
LogP: | 3.29680 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
DE-60221969-T2 | BY A PIPERIDINE-CONTAINING UNIT AT POSITION 4 SUBSTITUTED CHINOLINES AND THEIR NITROGEN-CONTAINING DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | 20010122 |
EP-1359908-A1 | Quinolines and nitrogenated derivatives thereof substituted in 4-position by a piperidine-containing moiety and their use as antibacterial agents | 20010122 |
EP-1359908-B1 | Quinolines and nitrogenated derivatives thereof substituted in 4-position by a piperidine-containing moiety and their use as antibacterial agents | 20010122 |
ES-2292716-T3 | QUINOLINAS AND NITROGEN DERIVATIVES OF THE SAME SUBSTITUTED IN POSITION 4 WITH A REST CONTAINING PIPERIDINE AND ITS USE AS ANTIBACTERIAL AGENTS. | 20010122 |
JP-2004520360-A | Quinoline substituted at position 4 by a piperidine-containing moiety and its nitrogenated derivatives and their use as antibacterials | 20010122 |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.05104734 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.05104734 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 48.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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