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13738-63-1

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Basic Information
CAS No.: 13738-63-1
Name: 1,5-dichloro-3-fluoro-2-(4-nitrophenoxy)benzene
Article Data: 2
Molecular Structure:
Molecular Structure of 13738-63-1 (1,5-dichloro-3-fluoro-2-(4-nitrophenoxy)benzene)
Formula: C12H6 Cl2 F N O3
Molecular Weight: 302.089
Synonyms: Ether,2,4-dichloro-6-fluorophenyl p-nitrophenyl (8CI);2,4-Dichloro-6-fluoro-4'-nitrodiphenyl ether; 2,4-Dichloro-6-fluorophenyl4-nitrophenyl ether; 2,4-Dichloro-6-fluorophenyl-p-nitrophenyl ether;2-Fluoro-4,6-dichloro-4'-nitrodiphenyl ether; 2-Fluoro-4,6-dichlorophenyl4-nitrophenyl ether; 4-Nitro-2',4'-dichloro-6'-fluorodiphenyl ether; CFNP;Fluoronitrofen
Density: 1.51g/cm3
Melting Point: 180-187 °C
Boiling Point: 333.7°Cat760mmHg
Flash Point: 155.6°C
Hazard Symbols: Moderately toxic by ingestion.
Safety: Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx, F−, and Cl−.
PSA: 55.05000
LogP: 5.35620
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Chemistry

Molecular Structure of Fluoronitrofen (CAS NO.13738-63-1):


IUPAC: 1,5-Dichloro-3-fluoro-2-(4-nitrophenoxy)benzene 
Molecular Formula: C12H6Cl2FNO3
Molecular Weight: 302.0853
Product Categories:Agricultural Chemical ; Herbicide
Density: 1.51 g/cm3
Flash Point: 155.6oC
Boiling Point: 333.7oC at 760 mmHg
Index of Refraction: 1.606
Molar Volume: 199.9 cm3
Surface Tension: 50.3 dyne/cm
Enthalpy of Vaporization: 55.38 kJ/mol
Vapour Pressure: 0.00026 mmHg at 25oC
SMILES: Clc2cc(Cl)cc(F)c2Oc1ccc([N+]([O-])=O)cc1 
InChI: InChI=1/C12H6Cl2FNO3/c13-7-5-10(14)12(11(15)6-7)19-9-3-1-8(2-4-9)16(17)18/h1-6H 
InChIKey: MVHWKYHDYCGNQN-UHFFFAOYAL 

Toxicity Data With Reference

1.    

orl-rat LD50:2890 mg/kg

     85ARAE    Agricultural Chemicals. 2 (1977),197.

Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx, F−, and Cl−.

Specification

 Fluoronitrofen with cas registry number of 13738-63-1 is also known as 2,4-Dichloro-6-fluorophenyl p-nitrophenyl ether ; 2,4-Dichloro-6-fluorophenyl-4'-nitrophenyl ether ; Benzene,1,5-dichloro-3-fluoro-2-(4-nitrophenoxy)- ; Benzene,1,5-dichloro-3-fluoro-2-(4-nitrophenoxy)- (9CI) ; Ether, 2,4-dichloro-6-fluorophenyl p-nitrophenyl . It would emit very toxic vapors when heated to decomposition. Fluoronitrofen with cas registry number of 13738-63-1 is used as a herbicide .