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Retrosynthesis · AI + evidence

3-(Trifluoromethyl)benzyl chloride (C8H6ClF3)

3-(Trifluoromethyl)benzyl chloride (C8H6ClF3; CAS 705-29-3) is a practical retrosynthesis target. 3-(Trifluoromethyl)benzyl chloride presents a C8 framework, aromatic rings, halogen substitution. Open AI route search in one click below.

Target
3-(Trifluoromethyl)benzyl chloride
CAS
705-29-3
Formula
C8H6ClF3
Approx. MW
194.58
SMILES
FC(F)(F)c1cccc(CCl)c1
PubChem CID
69716
Approx. carbons
C8

3-(Trifluoromethyl)benzyl chloride structure

Properties

IUPAC name
1-(chloromethyl)-3-(trifluoromethyl)benzene
Common names
705-29-3; 3-(Trifluoromethyl)benzyl chloride; 1-(Chloromethyl)-3-(trifluoromethyl)benzene; 3-Trifluoromethylbenzyl chloride; Benzene, 1-(chloromethyl)-3-(trifluoromethyl)-; m-Trifluoromethylbenzyl chloride; DTXSID0061036; RefChem:95495; DTXCID0046696; 3-(Chloromethyl)benzotrifluoride
Molecular weight
194.58
Exact mass
194.01
InChIKey
XGASTRVQNVVYIZ-UHFFFAOYSA-N

View on PubChem

3-(Trifluoromethyl)benzyl chloride 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-(Trifluoromethyl)benzyl chloride?

3-(Trifluoromethyl)benzyl chloride has molecular formula C8H6ClF3. Molecular weight about 194.58 g·mol⁻¹.

What is the CAS number of 3-(Trifluoromethyl)benzyl chloride?

The CAS Registry Number for 3-(Trifluoromethyl)benzyl chloride is 705-29-3.

Run AI retrosynthesis for 3-(Trifluoromethyl)benzyl chloride Target catalog AI tools overview

Open the planner with 3-(Trifluoromethyl)benzyl chloride preloaded, then keep routes that match CAS 705-29-3.

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(1-Bromoethyl)benzene(2-Chloroethoxy)benzene(2-Chloroethyl)benzene(Chloroethynyl)benzene[(2-Chloroethyl)sulfonyl]benzene1-(3-Bromo-4-fluorophenyl)ethanone

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References & tools