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1- (4-Fluorophenyl) piperazine

CAT: 0024-sc-255747Size: 10 gDry Ice: NoHazardous: No
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CAT#:0024-sc-255747Size:10 g
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CAS Number
2252-63-3

Chemical Information

1-(4-Fluorophenyl)piperazine
CAS Number2252-63-3
PubChem CID75260
IUPAC Name1-(4-fluorophenyl)piperazine
Molecular FormulaC10H13FN2
Molecular Weight180.22
XLogP1.3
Topological Polar Surface Area15.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity149
SMILES
C1CN(CCN1)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H13FN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChIKey
AVJKDKWRVSSJPK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Fluorophenyl)piperazine
CAS: 2252-63-3
CID: 75260
Formula: C10H13FN2
MW: 180.22
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight180.22
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass180.10627659
Monoisotopic Mass180.10627659
Topological Polar Surface Area15.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity149
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

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