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1- (4-Iodophenyl) -2-piperidinone

CAT: 0013-GTR19268169-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19268169-01Size:10 mg
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Description
1- (4-Iodophenyl) -2-piperidinone (1- (4-Iodophenyl) piperidin-2-one) serves as a pharmaceutical intermediate utilized in the synthesis of various active compounds.
CAS Number
385425-15-0
Smiles
O=C1N (C2=CC=C (I) C=C2) CCCC1
Molecular Formula
C11H12INO
Molecular Weight
301.12
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(4-Iodophenyl)piperidin-2-one
CAS Number385425-15-0
PubChem CID22352232
IUPAC Name1-(4-iodophenyl)piperidin-2-one
Molecular FormulaC11H12INO
Molecular Weight301.12
XLogP2.4
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity211
SMILES
C1CCN(C(=O)C1)C2=CC=C(C=C2)I
InChI
InChI=1S/C11H12INO/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h4-7H,1-3,8H2
InChIKey
OYDSTJMVOOOYDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Iodophenyl)piperidin-2-one
CAS: 385425-15-0
CID: 22352232
Formula: C11H12INO
MW: 301.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight301.12
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass300.99636
Monoisotopic Mass300.99636
Topological Polar Surface Area20.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity211
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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Alternative Products

CatalogName
TYD-03839-011- (4-Iodophenyl) -2-piperidinone
1614064-Hydroxy-2-piperidinone
sc-2672054-Amino-2-piperidinone
PC1075674-Amino-2-piperidinone trifluoroacetate
OR10978091- (4-Chlorophenyl) -2-piperidinone
OR964017-012-Methyl-4-piperidinone hydrochloride
OR965742-014- (S) -Hydroxy-2-piperidinone
430196-014-Amino-2-piperidinone Hydrochloride
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TRC-N504505-500MG1-(4-Nitrophenyl)-2-piperidinone

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