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Compound Fr14059

CAT: 0931-Fr14059-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr14059-02Size:100 mg
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CAS Number
17766-28-8
Purity
0.9969
Bioactivity
Compound Fr14059, with CAS No. 17766-28-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr14059 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.
Smiles
C1CCC(CC1)N1CCNCC1
Molecular Formula
C10H20N2
Molecular Weight
168.284
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Cyclohexylpiperazine

structure in first source

CAS Number17766-28-8
PubChem CID87298
IUPAC Name1-cyclohexylpiperazine
Molecular FormulaC10H20N2
Molecular Weight168.28
XLogP1.4
Topological Polar Surface Area15.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity124
SMILES
C1CCC(CC1)N2CCNCC2
InChI
InChI=1S/C10H20N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h10-11H,1-9H2
InChIKey
XPDSXKIDJNKIQY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Cyclohexylpiperazine
CAS: 17766-28-8
CID: 87298
Formula: C10H20N2
MW: 168.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.28
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass168.162648646
Monoisotopic Mass168.162648646
Topological Polar Surface Area15.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity124
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
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Fr14459-01Compound Fr14459
Fr14049-01Compound Fr14049
Fr14051-01Compound Fr14051
Fr14089-01Compound Fr14089
Fr14069-01Compound Fr14069
Fr14054-01Compound Fr14054

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HY-U00358Compound 2
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HY-14176-01Compound E
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MBS3613725-01Compound 3344
MBS3613444-01Compound W
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