2,4,6-Trichlorobenzonitrile

Name: 2,4,6-Trichlorobenzonitrile
Brand: ChemScene
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CAS No. 6575-05-9
Cat. No. CS-W015302
Purity≥97%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 6575-05-9

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Description

2,4,6-Trichlorobenzonitrile features a highly electron-deficient aromatic ring stabilized by three chlorine substituents flanking the nitrile group. This configuration enables direct electrophilic substitution and facilitates coupling reactions under mild conditions. The compound serves as a robust building block in synthetic organic chemistry, particularly for constructing halogenated heterocycles and functionalized aryl systems.

Application

2,4,6-Trichlorobenzonitrile serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of substituted heterocycles and functionalized aryl derivatives. Its three electron-withdrawing chlorine atoms enhance electrophilicity at the aromatic ring, facilitating nucleophilic aromatic substitution under mild conditions. The nitrile group provides a handle for further transformations, including hydrolysis to carboxylic acids or reduction to aldehydes. Bench-stable and readily purified by recrystallization, it functions reliably in scale-up workflows and is widely used in agrochemical and pharmaceutical intermediate synthesis.

General Information

CAS No. 6575-05-9
Cat. No. CS-W015302
Purity ≥97%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₂Cl₃N
Molecular Weight 206.45
Synonym(s) 2,4,6-trichlorohydrin
SMILES N#CC1=C(Cl)C=C(Cl)C=C1Cl

Computational Chemistry Data

TPSA 23.79
LogP 3.51848
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2,4,6-Trichlorobenzonitrile

CAS No. 6575-05-9

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