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

Technical Data

Safety and Hazards

Patents

Computed Properties

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

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

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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

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