Description

2-Chloro-6-(trifluoromethyl)aniline (CAS No. 433-94-3) is a high-purity organic compound with the molecular formula C₇H₅ClF₃N, widely utilized in pharmaceutical and agrochemical research. This aniline derivative features a chloro-substituted aromatic ring and a trifluoromethyl group, making it a versatile intermediate for synthesizing complex molecules. Its IUPAC name, 2-chloro-6-(trifluoromethyl)aniline, reflects its precise structural configuration. Suitable for laboratory use, this compound is rigorously tested for quality, ensuring optimal performance in synthetic applications. Available in various quantities, it is ideal for researchers requiring reliable and consistent chemical building blocks.

Properties

• CAS Number: 433-94-3
• Complexity: 159
• IUPAC Name: 2-chloro-6-(trifluoromethyl)aniline
• InChI: InChI=1S/C7H5ClF3N/c8-5-3-1-2-4(6(5)12)7(9,10)11/h1-3H,12H2
• InChI Key: OTRRSPQJZRCMDA-UHFFFAOYSA-N
• Exact Mass: 195.0062613
• Molecular Formula: C7H5ClF3N
• Molecular Weight: 195.57
• SMILES: C1=CC(=C(C(=C1)Cl)N)C(F)(F)F
• Topological: 26
• Monoisotopic Mass: 195.0062613
• Synonyms: 2-Chloro-6-(trifluoromethyl)aniline, 433-94-3, EINECS 207-091-8, DTXSID30195817, DTXCID70118308, 207-091-8, 2-Amino-3-chlorobenzotrifluoride, 2-Chloro-6-trifluoromethylaniline, MFCD00272565, 2-chloranyl-6-(trifluoromethyl)aniline, benzenamine, 2-chloro-6-(trifluoromethyl)-, SCHEMBL1000973, SCHEMBL1691710, SBB091921, AKOS000121361, CS-W002595, 2-chloro-6-(trifluoromethyl)phenylamine, 6-chloro-2-(trifluoromethyl)phenylamine, AS-30442, SY022855, DB-051075, A1510, NS00043354, ST50407321, EN300-16627, A824775, A826263, Z56347231

Application

2-Chloro-6-(trifluoromethyl)aniline serves as a key intermediate in the synthesis of pharmaceuticals, particularly in the development of active pharmaceutical ingredients (APIs) with trifluoromethyl groups. It is also employed in agrochemical research for creating herbicides and pesticides due to its structural properties. Additionally, this compound finds use in material science for designing specialized polymers and coatings with enhanced chemical resistance.

Safety and Hazards

GHS Hazard Statements

• H227 (14.3%): Combustible liquid [Warning Flammable liquids]
• H301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral]
• H302 (85.7%): Harmful if swallowed [Warning Acute toxicity, oral]
• H311 (14.3%): Toxic in contact with skin [Danger Acute toxicity, dermal]
• H312 (85.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]
• H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H330 (14.3%): Fatal if inhaled [Danger Acute toxicity, inhalation]
• H332 (85.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]
• H335 (28.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

• P210, P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403, P403+P233, P405, and P501

Hazard Classes and Categories

• Flam. Liq. 4 (14.3%)
• Acute Tox. 3 (14.3%)
• Acute Tox. 4 (85.7%)
• Acute Tox. 3 (14.3%)
• Acute Tox. 4 (85.7%)
• Skin Irrit. 2 (100%)
• Eye Irrit. 2A (100%)
• Acute Tox. 2 (14.3%)
• Acute Tox. 4 (85.7%)
• STOT SE 3 (28.6%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.