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Compound Fr13703

CAT: 0013-GTR19269961-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269961-02Size:25 mg
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Description
Compound Fr13703, with CAS No. 21168-71-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr13703 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
21168-71-8
Purity
98.00% (May vary between batches)
Smiles
CCN1CCC (CN) CC1
Molecular Formula
C8H18N2
Molecular Weight
142.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(1-Ethylpiperidin-4-yl)methanamine
CAS Number21168-71-8
PubChem CID2794704
IUPAC Name(1-ethylpiperidin-4-yl)methanamine
Molecular FormulaC8H18N2
Molecular Weight142.24
XLogP0.4
Topological Polar Surface Area29.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity85
SMILES
CCN1CCC(CC1)CN
InChI
InChI=1S/C8H18N2/c1-2-10-5-3-8(7-9)4-6-10/h8H,2-7,9H2,1H3
InChIKey
ZLODGCYXZYPQKQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (1-Ethylpiperidin-4-yl)methanamine
CAS: 21168-71-8
CID: 2794704
Formula: C8H18N2
MW: 142.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight142.24
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass142.146998583
Monoisotopic Mass142.146998583
Topological Polar Surface Area29.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity85.3
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

Related Products

CatalogName
GTR19269976-01Compound Fr13783
GTR19269971-01Compound Fr13753
GTR19269962-01Compound Fr13705
GTR19269960Compound Fr13702
GTR19269963-01Compound Fr13707
GTR19269947-01Compound Fr13663
GTR19269925-01Compound Fr13453
GTR19269881-01Compound Fr13143
GTR19269870-01Compound Fr13037
GTR19269867-01Compound Fr13007

Alternative Products

CatalogName
ALX-550-516-M025Compound A
XXC35825-01Compound 3a
Fr16729-01Compound Fr16729
PDK0296-01Compound PDK0296
PDK0264-01Compound PDK0264
Fr14090-01Compound Fr14090
Fr14018-01Compound Fr14018
Fr13991-01Compound Fr13991
Fr13830-01Compound Fr13830
Fr13814-01Compound Fr13814

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