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4-(4-Fluorophenyl)aniline

CAT: 0572-TRC-F594075-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F594075-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
324-93-6
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
Nc1ccc(cc1)c2ccc(F)cc2
Molecular Formula
C12H10FN
Molecular Weight
187.21
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

4'-Fluoro(1,1'-biphenyl)-4-amine
CAS Number324-93-6
PubChem CID9462
IUPAC Name4-(4-fluorophenyl)aniline
Molecular FormulaC12H10FN
Molecular Weight187.21
XLogP2.1
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity167
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)F)N
InChI
InChI=1S/C12H10FN/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,14H2
InChIKey
HTRVALPKPVGOSZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4'-Fluoro(1,1'-biphenyl)-4-amine
CAS: 324-93-6
CID: 9462
Formula: C12H10FN
MW: 187.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight187.21
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass187.079727485
Monoisotopic Mass187.079727485
Topological Polar Surface Area26 Ų
Heavy Atom Count14
Formal Charge0
Complexity167
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes