3-Chloro-5-trifluoromethylaniline

Name: 3-Chloro-5-trifluoromethylaniline
Brand: ChemScene
Availability: InStock
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CAS No. 69411-05-8
Cat. No. CS-W015716
Purity≥98%
MDL No.MFCD02684210

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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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3-Chloro-5-trifluoromethylaniline|CS-W015716

Structure of 69411-05-8

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General Information

CAS No. 69411-05-8
Cat. No. CS-W015716
Purity ≥98%
MDL No. MFCD02684210
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅ClF₃N
Molecular Weight 195.57
Synonym(s) 3-Chloro-5-(trifluoromethyl)aniline
SMILES C1=C(C=C(C=C1C(F)(F)F)N)Cl

Description

3-Chloro-5-trifluoromethylaniline features a trifluoromethyl group that enhances electron-withdrawing character and metabolic stability, while the chlorine substituent provides a reactive handle for cross-coupling. This aromatic amine integrates readily into pharmaceutical intermediates and functional materials under standard conditions.

Application

3-Chloro-5-trifluoromethylaniline serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct incorporation of electron-withdrawing trifluoromethyl and chloro substituents into aromatic scaffolds. Its reactivity facilitates palladium-catalyzed cross-coupling, nucleophilic substitution, and electrophilic aromatic substitution under standard conditions. The molecule exhibits good bench stability and is compatible with common protecting group strategies, making it suitable for multi-step synthesis workflows requiring functional group tolerance and predictable regiochemistry.

Synthesis

Route1
- In-stock
  
  401-93-4
- ~99%
- In-stock
  
  69411-05-8
References
- BRISTOL-MYERS SQUIBB COMPANY Patent: WO2009/3077 A1, 2008 ; Location in patent: Page/Page column 135 ;

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-H319
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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Computational Chemistry Data

TPSA 26.02
LogP 2.941
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Chloride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Chloro-5-trifluoromethylaniline

CAS No. 69411-05-8

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