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Name	Benzo[f]quinoline	EINECS	N/A
CAS No.	85-02-9	Density	1.187g/cm³
PSA	12.89000	LogP	3.38800
Solubility	Insoluble in water	Melting Point	89-91 °C
Formula	C13H9 N	Boiling Point	349 °C (721 mmHg)
Molecular Weight	179.221	Flash Point	166 °C
Transport Information	N/A	Appearance	BROWN CRYSTALLINE POWDER
Safety	Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x.	Risk Codes	40-36/37/38
Molecular Structure		Hazard Symbols
Synonyms	1-Azaphenanthrene;5,6-Benzo[f]quinoline; 5,6-Benzoquinoline; NSC 9850; b-Naphthoquinoline	Article Data	35

Benzo[f]quinoline Synthetic route

: 17104-69-7
5,6-benzoquinoline N-oxide

: 85-02-9
benzo[f]quinoline

Conditions

Conditions	Yield
With Methyl phenyldiazoacetate; copper(II) bis(trifluoromethanesulfonate) In 1,2-dichloro-ethane at 60℃; for 12h; Inert atmosphere; Sealed tube; Molecular sieve;	92%

: 1086561-19-4
2-(2-methyl-pyridin-3-yl)-benzaldehyde

: 85-02-9
benzo[f]quinoline

Conditions

Conditions	Yield
With potassium tert-butylate In N,N-dimethyl-formamide at 20℃;	80%

: 91-59-8
naphthalen-2-ylamine

: 504-63-2
trimethyleneglycol

: 85-02-9
benzo[f]quinoline

Conditions

Conditions	Yield
With 2,4,6-trimethyl-pyridine; oxygen; palladium diacetate; trifluoroacetic acid at 150℃; for 16h; Schlenk technique;	80%

: 17104-69-7
5,6-benzoquinoline N-oxide

A: 85-02-9
benzo[f]quinoline

B: 23981-08-0
benzoquinolin-1(2H)-one

C: 75539-85-4
2,3-dihydro-1H-benzindole-3-carbaldehyde

Conditions

Conditions	Yield
In water at 16℃; Irradiation;	A 3% B 74% C 4%

: di-tert-butyl 1-cyclopropyl-2-(naphthalen-2-yl)hydrazine-1,2-dicarboxylate

: 85-02-9
benzo[f]quinoline

Conditions

Conditions	Yield
With phosphoric acid In water; 1,2-dichloro-benzene at 170℃; under 760.051 Torr; for 24h;	74%

: 17104-69-7
5,6-benzoquinoline N-oxide

A: 85-02-9
benzo[f]quinoline

B: 75539-85-4
2,3-dihydro-1H-benzindole-3-carbaldehyde

Conditions

Conditions	Yield
In cyclohexane at 16℃; Irradiation;	A 9% B 66%

: 20191-75-7
1-bromo-2-naphthylamine

: 56-81-5
glycerol

: 85-02-9
benzo[f]quinoline

Conditions

Conditions	Yield
With sulfuric acid at 150℃;

: 831-91-4
Benzyl phenyl sulfide

: 72490-90-5
benzoquinoline radical ion

A: 85-02-9
benzo[f]quinoline

B: 2154-56-5
benzyl radical

C: 13133-62-5
thiophenolate

Conditions

Conditions	Yield
With tetrabutylammonium perchlorate In N,N-dimethyl-formamide at 25℃; Rate constant; Thermodynamic data; ΔG0, cyclovoltammetry;

polystyrene: polystyrene

A: 229-87-8
phenanthridine

B: 85-02-9
benzo[f]quinoline

C: 84-15-1
o-terphenyl

D: 20279-21-4
1,2,3,10b-tetrahydrofluoranthene

Conditions

Conditions	Yield
With air at 900℃; Condensation; combustion; pyrolysis; PAH formation; Formation of xenobiotics; Further byproducts given. Title compound not separated from byproducts;	A 0.04 mg B 0.12 mg C 0.19 mg D 0.16 mg

: 538-49-8
2-[(E)-2-phenylethenyl]pyridine

A: 85-02-9
benzo[f]quinoline

B: 538-49-8, 714-08-9, 1519-59-1
(Z)-2-(2-phenylethenyl)pyridine

C: 83023-13-6
rac-2,2'-((1R,2R,3S,4S)-2,4-diphenylcyclobutane-1,3-diyl)dipyridine

Conditions

Conditions	Yield
With cyclomaltooctaose Product distribution; Further Variations:; Reagents; Solvents; Dimerization; Isomerization, Aromatization; Irradiation;

Benzo[f]quinoline Chemical Properties

IUPAC Name: Benzo[f]quinoline
Synonyms: beta-Naphthoquinoline ; Benzo[f]quinoline ; b-Naphthoquinoline ; Naphthopyridine ; 1-Azaphenanthrene ; 5,6-Benzo(f)quinoline ; 5,6-benzoquinoline
CAS NO: 85-02-9
Molecular Formula of Benzo[f]quinoline (CAS NO.85-02-9) : C₁₃H₉N
Molecular Weight of Benzo[f]quinoline (CAS NO.85-02-9) : 179.22
Molecular Structure of Benzo[f]quinoline (CAS NO.85-02-9) :
EINECS: 201-582-0
Mol File: 85-02-9.mol
Merck : 1105
Index of Refraction: 1.726
Surface Tension: 54 dyne/cm
Density: 1.187 g/cm3
Flash Point: 155.9 °C
Enthalpy of Vaporization: 57.15 kJ/mol
Boiling Point: 350.4 °C at 760 mmHg
Vapour Pressure: 8.89E-05 mmHg at 25°C
Melting point: 89-91 °C
Appearance:Yellow crystals or white powder

Benzo[f]quinoline Uses

Benzo[f]quinoline (CAS NO.85-02-9) is use as raw materials of organic synthesis .

Benzo[f]quinoline Toxicity Data With Reference

1.		mma-sat 50 µg/plate		50NNAZ Polynuclear Aromatic Hydrocarbons: Mechanisms, Methods and Metabolism, Papers of the 8th International Symposium, Columbus, OH, 1983. 7 (1983),73.
2.		pic-esc 7500 ng/well		MUREAV Mutation Research. 260 (1991),349.

Benzo[f]quinoline Consensus Reports

EPA Genetic Toxicology Program.

Benzo[f]quinoline Safety Profile

Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x.
Hazard Codes Harmful Xn
Risk Statements 40-36/37/38
S40:To clean the floor and all objects contaminated by this material, use .... (there follows suitable cleaning material).
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 45-36/37/39-26
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
RTECS DK1428000

Benzo[f]quinoline Specification

1.General Description :Yellow crystals or white powder. Characteristic irritating odor.
2.Air & Water Reactions: Sensitive to prolonged exposure to air. Insoluble in water.
Reactivity Profile : 5,6-Benzoquinoline neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. May generate hydrogen, a flammable gas, in combination with strong reducing agents such as hydrides.
3.Fire Hazard : 5,6-Benzoquinoline is combustible.

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