1-(Chlorophenylmethyl)-4-fluorobenzene
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Basic information
- CAS
365-21-9- Standard SMILES
Fc1ccc(C(Cl)c2ccccc2)cc1- InChIKey
GNFODANOHXAUPE-UHFFFAOYSA-N- Molecular formula
- C13H10ClF
- Average molar mass
- 220.67 g/mol
- Monoisotopic mass
- 220.0455062
Names & identifiers
- Preferred name
- 1-(Chlorophenylmethyl)-4-fluorobenzene
- IUPAC
- 1-[chloro(phenyl)methyl]-4-fluorobenzene
- English name
- 1-(chlorophenylmethyl)-4-fluorobenzene
- Molecular formula
- C13H10ClF
- Molecular weight
- 220.67
Names & synonyms
365-21-91-(Chlorophenylmethyl)-4-fluorobenzeneEINECS 206-670-2RefChem:74658206-670-24-Fluorobenzhydryl chloride1-[chloro(phenyl)methyl]-4-fluorobenzene1-(Chloro(phenyl)methyl)-4-fluorobenzeneBenzene,1-(chlorophenylmethyl)-4-fluoro-MFCD07782168SCHEMBL6485306DTXSID40957802
Show more names
RMA-6811-(Chlorophenylmethyl)-4-fluorobenzenBenzene, 1-(chlorophenylmethyl)-4-fluoro-
AKOS009237886FS-63931-[chloro(phenyl)methyl]-4-fluoro-benzeneDB-006814NS00042164(+/-)-1-(Chlorophenylmethyl)-4-fluorobenzeneF024616
Database identifiers
- CAS
365-21-9- PubChem CID
- 216256
- DTXSID
DTXSID40957802- EC Number
- 206-670-2
- Nikkaji
- J193.871A
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate, Methanol
- form
- Oil
- color
- Clear Colorless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Applications
Uses1-(Chlorophenylmethyl)-4-fluorobenzene is an intermediate in synthesizing Defluoro Flunarizine Dihydrochloride (D228700), an impurity of Flunarizine(F455200, Dihydrochloride), which is a calcium channel blocker. Flunarizine is a fluorinated derivative of Cinnarizine and a vasodilator (cerebral and peripheral).
Upstream & downstream products
Upstream raw materials
Related reactions
1 records
Compound notes
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