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CAS No.: | 79622-59-6 |
---|---|
Name: | Fluazinam |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C13H4Cl2F6N4O4 |
Molecular Weight: | 465.096 |
Synonyms: | Frowncide;Frowncide SC;IKF 1216;Mapro;PP 192;Shirlan (Zeneca);ASC66825;ASC 67178;Altima; |
EINECS: | 200-835-2 |
Density: | 1.766 g/cm3 |
Melting Point: | 113 °C |
Boiling Point: | 376.1 °C at 760 mmHg |
Flash Point: | 181.3 °C |
Solubility: | 1.7 mg l-1 (25 °C) |
Appearance: | Light yellow crystals |
Hazard Symbols: | T,N |
Risk Codes: | 23-41-43-50/53-36-20/21/22-11 |
Safety: | 26-36/37/39-45-60-61-36/37-16 |
Transport Information: | UN 2811 |
PSA: | 116.56000 |
LogP: | 7.10540 |
2,4-dichloro-3,5-dinitro-benzotrifluoride
2-amino-3-chloro-5-(trifluoromethyl)pyridine
fluazinam
Conditions | Yield |
---|---|
With potassium hydroxide In 2-methyltetrahydrofuran at 20℃; for 4h; Concentration; Temperature; Solvent; | 98% |
Stage #1: 2,4-dichloro-3,5-dinitro-benzotrifluoride; 2-amino-3-chloro-5-(trifluoromethyl)pyridine With methoxybenzene; potassium hydroxide at 55℃; for 6h; Stage #2: With hydrogenchloride at 85℃; pH=3.7; Temperature; Reagent/catalyst; pH-value; | 98.5% |
With edetate disodium; potassium hydroxide In acetonitrile at 0 - 5℃; for 3h; Reagent/catalyst; Temperature; | 97.5% |
3-trichloromethyl-pyridine
fluazinam
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: phosphorus pentachloride / 16 h / 210 °C / Autoclave 2: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 3: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 4: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme | |
Multi-step reaction with 5 steps 1: phosphorus pentachloride / 16 h / 210 °C / Autoclave 2: phosphorus pentachloride / 16 h / 210 °C / Autoclave 3: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 4: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 5: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme |
fluazinam
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: phosphorus pentachloride / 16 h / 210 °C / Autoclave 2: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 3: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 4: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme |
nicotinic acid
fluazinam
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: phosphorus pentachloride / 14 h / 210 °C / 1500.15 - 27752.8 Torr / Autoclave 2: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 3: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 4: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme | |
Multi-step reaction with 4 steps 1: phosphorus pentachloride / 64 h / 185 °C / 18751.9 - 30003 Torr / Autoclave 2: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 3: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 4: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme | |
Multi-step reaction with 4 steps 1: phosphorus pentachloride / 72 h / 185 °C / 18751.9 - 30003 Torr / Autoclave 2: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 3: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 4: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme |
2,3-dichloro-5-(trichloromethyl)pyridine
fluazinam
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: hydrogen fluoride; iron(III) chloride; pyridine / 130 - 175 °C / Autoclave 2: ammonia / water / 9 h / 80 °C / 13501.4 - 16501.7 Torr / Autoclave 3: potassium hydroxide / acetonitrile / 6.25 h / 5 - 40 °C View Scheme |
2,3-dichloro-5-trifluoromethylpyridine
fluazinam
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1.1: ammonia / tetrahydrofuran / 28 h / 100 °C / 4500.45 - 12001.2 Torr / Autoclave; Inert atmosphere 2.1: potassium hydroxide / tetrahydrofuran / 1 h / 0 - 5 °C 2.2: 3.5 h / 0 - 10 °C View Scheme |
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 0 - 25℃; for 19h; | 70% |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: triethylamine / dichloromethane / 19 h / 0 - 25 °C 2: trifluoroacetic anhydride; trifluoroacetic acid / acetonitrile / 1.25 h / 0 °C / Inert atmosphere View Scheme |
Product Name: Fluazinam (CAS NO.79622-59-6)
Molecular Formula:C13H4Cl2F6N4O4
Molar mass:465.091679g/mol
Density:1.766 g/cm3
Melting point:113°C
Boiling Point:376.1 °C at 760 mmHg
Index of Refraction:1.571
Vapour Pressure:7.41E-06 mmHg at 25°C
Storage temp:2-8°C
Index of Refraction: 1.571
Molar Refractivity: 86.55 cm3
Molar Volume: 263.3 cm3
XLogP3-AA: 6
H-Bond Donor: 1
H-Bond Acceptor: 12
Structure Descriptors of Fluazinam (CAS NO.79622-59-6):
IUPAC Name: 3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine
Canonical SMILES: C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C
(F)(F)F
InChI: InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)
InChIKey: UZCGKGPEKUCDTF-UHFFFAOYSA-N
Product Categories: API intermediates
Fluazinam (CAS NO.79622-59-6) is very effective to Botrytis genus Phytophthora, Plasmopara genus Sclerotinia spp and Cladosporium spp bacteria.
1. | orl-qal LD50:1782 mg/kg | HBPTO* Handbook of pesticide toxicology. 2 (2001),1229. | ||
2. | ihl-rat LC50:470 mg/m3 | HBPTO* Handbook of pesticide toxicology. 2 (2001),1229. |
Moderately toxic by ingestion and inhalation. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx, F−, and Cl−.
Safety Information of Fluazinam (CAS NO.79622-59-6):
Hazard Codes:T;N,N,T,Xn,F
Risk Statements:
11: Highly Flammable
20: Harmful by inhalation
21: Harmful in contact with skin
22: Harmful if swallowed
23: Toxic by inhalation
36: Irritating to the eyes
41: Risk of serious damage to eyes
43: May cause sensitization by skin contact
50: Very Toxic to aquatic organisms
53: May cause long-term adverse effects in the aquatic environment
Safety Statements:
16: Keep away from sources of ignition - No smoking
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
60: This material and/or its container must be disposed of as hazardous waste
61: Avoid release to the environment. Refer to special instructions safety data sheet
Fluazinam , its CAS NO. is 79622-59-6, the synonyms are 3-Chloro-n-(3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl)-5-(trifluoromethyl)-2-pyridinamine ; 3-Chloro-n-(3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl)-5-2-pyridinamin ; Frowncide ; Shirlan Flow ; Shirlan (Zeneca) ; Fluazinam solution .