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Trans-2,5-Diethylpiperazine

CAT: 0804-HY-24239A-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-24239A-01Size:100 mg
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Description
Trans-2,5-Diethylpiperazine is a drug intermediate for synthesis of various active compounds.
CAS Number
6189-24-8
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Drug Intermediate
Related Pathways
Others
Field of Research
Others
Purity
99.74
Smiles
CC[C@@H]1NC[C@@H](CC)NC1
Molecular Formula
C8H18N2
Molecular Weight
142.25
Precautions
H302, H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound2
Clinical Information
No Development Reported

Chemical Information

(2S,5R)-2,5-Diethyl-piperazine
CAS Number6189-24-8
PubChem CID55254911
IUPAC Name(2R,5S)-2,5-diethylpiperazine
Molecular FormulaC8H18N2
Molecular Weight142.24
XLogP1.1
Topological Polar Surface Area24.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity81
SMILES
CC[C@H]1CN[C@@H](CN1)CC
InChI
InChI=1S/C8H18N2/c1-3-7-5-10-8(4-2)6-9-7/h7-10H,3-6H2,1-2H3/t7-,8+
InChIKey
JIAOVIBEPXQRNK-OCAPTIKFSA-N
Chemical Structure
2D Structure
2D structure of (2S,5R)-2,5-Diethyl-piperazine
CAS: 6189-24-8
CID: 55254911
Formula: C8H18N2
MW: 142.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight142.24
XLogP31.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass142.146998583
Monoisotopic Mass142.146998583
Topological Polar Surface Area24.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity81.3
Isotope Atom Count0
Defined Atom Stereocenter Count2
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-04228-01Trans-2,5-Diethylpiperazine
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