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Flunarizine Impurity 24

CAT: 1299-RM-F121424-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F121424-01Size:10 mg
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CAS Number
1247405-07-7
Synonyms
1- (bromo (4-fluorophenyl) methyl) -2-fluorobenzene
Molecular Formula
C13H9BrF2
Molecular Weight
283.12
Target Alternative Name
Flunarizine
Product Name Synonym
1- (bromo (4-fluorophenyl) methyl) -2-fluorobenzene

Chemical Information

1-(Bromo(4-fluorophenyl)methyl)-2-fluorobenzene
CAS Number1247405-07-7
PubChem CID61085935
IUPAC Name1-[bromo-(2-fluorophenyl)methyl]-4-fluorobenzene
Molecular FormulaC13H9BrF2
Molecular Weight283.11
XLogP4.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity214
SMILES
C1=CC=C(C(=C1)C(C2=CC=C(C=C2)F)Br)F
InChI
InChI=1S/C13H9BrF2/c14-13(9-5-7-10(15)8-6-9)11-3-1-2-4-12(11)16/h1-8,13H
InChIKey
JAKHQLDMTLBVIG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(Bromo(4-fluorophenyl)methyl)-2-fluorobenzene
CAS: 1247405-07-7
CID: 61085935
Formula: C13H9BrF2
MW: 283.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight283.11
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass281.98557
Monoisotopic Mass281.98557
Topological Polar Surface Area0 Ų
Heavy Atom Count16
Formal Charge0
Complexity214
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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