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218111

Sigma-Aldrich

2-Chloro-6-fluorobenzyl chloride

98%

Synonym(s):

2,α-Dichloro-6-fluorotoluene

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About This Item

Linear Formula:
ClC6H3(F)CH2Cl
CAS Number:
55117-15-2
Molecular Weight:
179.02
EC Number:
259-487-5
MDL number:
MFCD00000896
UNSPSC Code:
12352100
PubChem Substance ID:
24853046
NACRES:
NA.22

Assay

98%

form

liquid

refractive index

n20/D 1.537 (lit.)

density

1.401 g/mL at 25 °C (lit.)

functional group

chloro
fluoro

SMILES string

Fc1cccc(Cl)c1CCl

InChI

1S/C7H5Cl2F/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2

InChI key

MJGOLNNLNQQIHR-UHFFFAOYSA-N

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Application

2-Chloro-6-fluorobenzyl chloride was used:
  • as alkylating reagent during the synthesis of 3-benzylsulfanyl derivatives of 1,2,4-triazole and 4-methyl-1,2,4-triazole[1]
  • in the preparataion of 2-chloro-6-fluorobenzylamine, required for the synthesis of 9-substituted adenine[2]
  • in the preparation of aprinocid via reaction with adenine[3]

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

200.1 °F - closed cup

Flash Point(C)

93.4 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
STBJ3947
STBF1843V
STBB2897V
STBB2897
S15881

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Vera Klimesová et al.
Farmaco (Societa chimica italiana : 1989), 59(4), 279-288 (2004-04-15)
Series of 3-benzylsulfanyl derivatives of 1,2,4-triazole and 4-methyl-1,2,4-triazole were synthesized by alkylation of starting triazole-3-thiol with appropriately substituted benzyl halide. All members of the set were evaluated for in vitro antimycobacterial activity against Mycobacterium tuberculosis, M. avium, and two strains
Tissue residues of arprinocid in chickens. 1. Depletion of residues in tissues of chickens fed carbon-14-labeled arprinocid.
T A Jacob et al.
Journal of agricultural and food chemistry, 30(2), 248-253 (1982-03-01)
New synthesis of a 9-substituted adenine.
Hartman GD, et al.
The Journal of Organic Chemistry, 43(5), 960-962 (1978)

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