2-Chloro-3,5-dinitrobenzotrifluoride TCI C1036

Chemical Identity

Other names: 2-Chloro-1,5-dinitro-3-(trifluoromethyl)benzene
CAS No.: 392-95-0
Formula: C7H2ClF3N2O4
Molecular weight: 270.55 g/mol
Purity: >99.0%(GC)

Full identifiers (IUPAC, SMILES, InChIKey)

IUPAC: 2-chloro-1,5-dinitro-3-(trifluoromethyl)benzene
SMILES: C1=C(C=C(C(=C1C(F)(F)F)Cl)[N+](=O)[O-])[N+](=O)[O-]
InChIKey: RLXKADBMLQPLDV-UHFFFAOYSA-N
MDL: MDL00007076
PubChem: CID 67851

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2-Chloro-3,5-dinitrobenzotrifluoride (TCI C1036, CAS 392-95-0) is a highly activated aromatic building block bearing two nitro groups and a trifluoromethyl substituent. These strong electron-withdrawing groups make the chlorine atom exceptionally reactive toward nucleophilic aromatic substitution with amines, thiols, and alcohols. It is therefore valued both as a synthetic intermediate for fluorinated aromatics and as a derivatizing reagent for amine-containing analytes. AMI Scientific supplies this product in a 5 g research-scale pack, and it should be handled in a fume hood with appropriate protective equipment.

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